SCHEMBL676679

SCHEMBL676679

CN[C@H]1CN(c2ccc3c(=O)c(C)cn(-c4nccs4)c3n2)C[C@@H]1OC

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
PPARG P37231 1/20 0.32
MAPK10 P53779 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
CHRNA7 P36544 3/20 0.31
HTR3A P46098 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL763215 0.89 OPRK1 (0.31) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL15929815 0.89 HTR3A (0.36) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL1611020 0.89 ALDH1A1 (0.31) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL13212352 0.88 ALDH1A1 (0.32) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL16088864 0.88 CHRNA7 (0.33) ALDH1A1KMT2ACHRNA7HTR3A
Hydrochloric Acid SCHEMBL7835718 0.88 OPRK1 (0.31) ALDH1A1PPARGMAPK10KMT2ANPSR1
Vosaroxin SCHEMBL674441 0.88 HTR3A (0.35) ALDH1A1PPARGMAPK10KMT2ANPSR1
Vosaroxin SCHEMBL195037 0.88 HTR3A (0.35) ALDH1A1PPARGMAPK10KMT2ANPSR1
Hydrochloric Acid SCHEMBL7835735 0.88 OPRK1 (0.31) ALDH1A1PPARGMAPK10KMT2ANPSR1
Vosaroxin SCHEMBL3207291 0.88 HTR3A (0.35) ALDH1A1PPARGMAPK10KMT2ANPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580814-B2 Methods of using (+)-1,4-dihydro-7-[(3S,4S)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4- oxo-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid for treatment of cancer SUNESIS PHARMACEUTICALS, INC. (US) 2013-11-12 US disclosed
US-8518872-B2 Methods of using (+)-1,4-dihydro-7-[(3S,4S)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4-OXO-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid in combination therapy SUNESIS PHARMACEUTICALS, INC. (US) 2013-08-27 US disclosed
US-8497282-B2 Method of preparing (+)-1,4-dihydro-7-[(3S,4S)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid SUNESIS PHARMACEUTICALS, INC. (US) 2013-07-30 US disclosed
US-8138202-B2 Stable SNS-595 compositions and methods of preparation SUNESIS PHARMACEUTICALS, INC. (US) 2012-03-20 US disclosed
US-7968565-B2 Therapeutic combinations comprising (+)-1,4-dihydro-7-[(3S,4S)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid SUNESIS PHARMACEUTICALS, INC. (US) 2011-06-28 US disclosed
US-20110086876-A1 STABLE SNS-595 COMPOSITIONS AND METHODS OF PREPARATION SUNESIS PHARMACEUTICALS, INC. 2011-04-14 US disclosed
US-20110082169-A1 Stable SNS-595 Compositions and Methods of Preparation SUNESIS PHARMACEUTICALS, INC. 2011-04-07 US disclosed
US-20100297142-A1 METHODS OF USING (+)-1,4-DIHYDRO-7-[(3S,4S)-3-METHOXY-4-(METHYLAMINO)-1-PYRROLIDINYL]-4-OXO-1-(2-THIAZOLYL)-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID IN COMBINATION THERAPY SUNESIS PHARMACEUTICALS, INC. 2010-11-25 US disclosed
US-7829577-B2 Voreloxin( SNS-595 ) and methanesulfonic acid ( for adjusting ph acidic) as anticarcinogenic agent DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-11-09 US disclosed
US-20100203162-A1 Method of preparing (+)-1,4-dihydro-7-[(3S,4S)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid SUNESIS PHARMACEUTICALS, INC. 2010-08-12 US disclosed
US-20100203162-A1 Method of preparing (+)-1,4-dihydro-7-[(3S,4S)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid SUNESIS PHARMACEUTICALS, INC. 2010-08-12 US disclosed
US-20100048609-A1 PHARMACEUTICAL DOSAGE FORMS FOR (+)-1,4-DIHYDRO-7-[(3S,4S)-3-METHOXY-4-(METHYLAMINO)-1-PYRROLIDINYL]-4-OXO-1-(2-THIAZOLYL)-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID SUNESIS PHARMACEUTICALS, INC. 2010-02-25 US disclosed
US-20090263393-A1 Methods of using(+)-1,4-dihydro-7-[(3s,4s)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4 -oxo-1-(2-thiazolyl)- 1,8-naphthyridine-3-carboxylic acid for treatment of cancer SUNESIS PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090181377-A1 HUMAN RIBOSOMAL DNA (rDNA) AND RIBOSOMAL RNA (rRNA) NUCLEIC ACIDS AND USES THEREOF CYLENE PHARMACEUTICALS, INC. (US) 2009-07-16 US disclosed
US-20070117770-A1 Human ribosomal DNA (rDNA) and ribosomal RNA (rRNA) nucleic acids and uses thereof CYLENE PHARMACEUTICALS, INC. (US) 2007-05-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110082169-A1 Stable SNS-595 Compositions and Methods of Preparation NES, NCDN, NCL ALDH1A1 3346/4885PPARG 3341/4885MAPK10 2861/4885
US-20090263393-A1 Methods of using(+)-1,4-dihydro-7-[(3s,4s)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4 -oxo-1-(2-thiazolyl)- 1,8-naphthyridine-3-carboxylic acid for treatment of cancer IL2, PBK, MALT1 ALDH1A1 60/4885PPARG 81/4885MAPK10 3787/4885
US-20100203162-A1 Method of preparing (+)-1,4-dihydro-7-[(3S,4S)-3-methoxy-4-(methylamino)-1-pyrrolidinyl]-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine-3-carboxylic acid CYP7A1, MT-ND1, DNM1 ALDH1A1 66/4885PPARG 690/4885MAPK10 4499/4885
US-20100048609-A1 PHARMACEUTICAL DOSAGE FORMS FOR (+)-1,4-DIHYDRO-7-[(3S,4S)-3-METHOXY-4-(METHYLAMINO)-1-PYRROLIDINYL]-4-OXO-1-(2-THIAZOLYL)-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID MLNR, SMN1; SMN2, MLN ALDH1A1 273/4885PPARG 2111/4885MAPK10 3629/4885
US-20110086876-A1 STABLE SNS-595 COMPOSITIONS AND METHODS OF PREPARATION NES, NCDN, NCL ALDH1A1 3346/4885PPARG 3341/4885MAPK10 2861/4885
US-20100297142-A1 METHODS OF USING (+)-1,4-DIHYDRO-7-[(3S,4S)-3-METHOXY-4-(METHYLAMINO)-1-PYRROLIDINYL]-4-OXO-1-(2-THIAZOLYL)-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID IN COMBINATION THERAPY TYMP, TYMS, NCL ALDH1A1 492/4885PPARG 1760/4885MAPK10 4013/4885
US-20090181377-A1 HUMAN RIBOSOMAL DNA (rDNA) AND RIBOSOMAL RNA (rRNA) NUCLEIC ACIDS AND USES THEREOF NOP2, POLRMT, FBL ALDH1A1 4046/4885PPARG 4751/4885MAPK10 4120/4885
US-20070117770-A1 Human ribosomal DNA (rDNA) and ribosomal RNA (rRNA) nucleic acids and uses thereof NOP2, POLRMT, FBL ALDH1A1 4046/4885PPARG 4751/4885MAPK10 4120/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.