SCHEMBL7835847

SCHEMBL7835847

CCOC(=O)/C(=C\Nc1nccs1)C(=O)c1ccc(Cl)nc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.48
ALDH1A1 P00352 4/20 0.48
NPSR1 Q6W5P4 1/20 0.43
MAPT P10636 4/20 0.42
MAPK1 P28482 2/20 0.42
HTT P42858 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 7/20 0.41
MEN1 O00255 6/20 0.41
KDM4E B2RXH2 2/20 0.39
DHODH Q02127 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
ALOX15 P16050 1/20 0.38
GAA P10253 3/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.37

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
SCHEMBL7835848 1.00 PKM (0.48) PKMALDH1A1NPSR1MAPTMAPK1
SCHEMBL12458210 0.85 NPC1 (0.40) ALDH1A1MAPTHTTCYP1A2CYP2D6
SCHEMBL12646742 0.85 ALDH1A1 (0.47) PKMALDH1A1NPSR1MAPTMAPK1
SCHEMBL7836695 0.84 ALDH1A1 (0.49) PKMALDH1A1NPSR1MAPTMAPK1
SCHEMBL7836692 0.84 ALDH1A1 (0.49) PKMALDH1A1NPSR1MAPTMAPK1
SCHEMBL10979799 0.82 ALDH1A1 (0.65) PKMALDH1A1NPSR1MAPTMAPK1
SCHEMBL7823361 0.80 ALDH1A1 (0.45) PKMALDH1A1NPSR1MAPTMAPK1
SCHEMBL7823363 0.80 ALDH1A1 (0.45) PKMALDH1A1NPSR1MAPTMAPK1
SCHEMBL25691621 0.76 CYP3A4 (0.46) ALDH1A1NPSR1MAPTMAPK1CYP1A2
SCHEMBL18949530 0.76 MEN1 (0.41) ALDH1A1NPSR1MAPTMAPK1CYP1A2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676774-B2 Compounds and compositions for treatment of cancer SUNESIS PHARMACEUTICALS, INC. (US) 2017-06-13 US disclosed
US-20170101404-A1 COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF CANCER SUNESIS PHARMACEUTICALS INC (US) 2017-04-13 US disclosed
US-8765954-B2 1,8-naphthyridine compounds for the treatment of cancer SUNESIS PHARMACEUTICALS, INC. (US) 2014-07-01 US disclosed
US-20120245198-A1 COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF CANCER SUNESIS PHARMACEUTICALS INC. 2012-09-27 US disclosed
US-8124773-B2 1,8-naphthyridine compounds for the treatment of cancer SUNESIS PHARMACEUTICALS, INC. (US) 2012-02-28 US disclosed
US-20100029708-A1 COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF CANCER SUNESIS PHARMACEUTICALS, INC. 2010-02-04 US disclosed
EP-0787726-B1 NOVEL COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ANTITUMOR AGENT DAINIPPON PHARMACEUTICAL CO (JP) 2001-11-28 EP disclosed
US-5817669-A A COMPOUND CONTAINING 1-(2-THIAZOLYL)-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-10-06 US disclosed
EP-0787726-A1 NOVEL COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ANTITUMOR AGENT DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1997-08-06 EP 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 (3 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-20120245198-A1 COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF CANCER NTPCR, NNMT, NES PKM 1916/4885ALDH1A1 2487/4885NPSR1 558/4885
US-20170101404-A1 COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF CANCER NTPCR, NNMT, NES PKM 1916/4885ALDH1A1 2487/4885NPSR1 558/4885
US-20100029708-A1 COMPOUNDS AND COMPOSITIONS FOR TREATMENT OF CANCER NTPCR, NNMT, NES PKM 1916/4885ALDH1A1 2487/4885NPSR1 558/4885

“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.