SCHEMBL1507775

SCHEMBL1507775

CCCCN(c1ccc2cccc([N+](=O)[O-])c2n1)c1ccc2cccc([N+](=O)[O-])c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.46
MEN1 O00255 9/20 0.41
KMT2A Q03164 9/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 6/20 0.41
MAPT P10636 5/20 0.41
NPSR1 Q6W5P4 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
THRB P10828 1/20 0.40
GAA P10253 1/20 0.40
DHFR P00374 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TXNRD1 Q16881 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39

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
SCHEMBL359691 0.76 METAP2 (0.47) MEN1KMT2AHPGDLMNANPC1
SCHEMBL1507976 0.76 DHFR (0.49) ALDH1A1DHFR
SCHEMBL1507677 0.74 PDE10A (0.46) PDE10AMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL9501972 0.73 PDE10A (0.54) PDE10AMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL1784500 0.71 DHFR (0.44) KMT2AHPGDLMNAMAPTNPSR1
SCHEMBL230859 0.70 RELA (0.59) PDE10AMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL15886634 0.70 NCF1 (0.56) DHFR
SCHEMBL1507695 0.68 TLR8 (0.53) PDE10ANOS1NOS2PABPC1
SCHEMBL1031078 0.67 PDE10A (0.59) PDE10AMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL22119735 0.67 PDE10A (0.59) PDE10AMEN1KMT2ASMN1; SMN2HPGD

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
CN-107987016-B Crystal of compound N-butyl-2, 2' -imino-bis (8-quinolinamine), pharmaceutical composition and application thereof 广州威尔曼新药研发有限公司 2022-05-27 CN disclosed
EP-1919894-B1 NOVEL POLYQUINOLINE DERIVATIVES AND THE THERAPEUTIC USE THEREOF PALUMED SA (FR) 2014-10-08 EP disclosed
US-8324196-B2 Polyquinoline derivatives and the therapeutic use thereof PALUMED S.A. (FR) 2012-12-04 US disclosed
US-20120277265-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THE THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2012-11-01 US disclosed
US-8247396-B2 Polyquinoline derivatives and therapeutic use thereof PALUMED S.A. (FR) 2012-08-21 US disclosed
EP-2289891-A2 Novel polyquinoline derivates and the therapeutic use thereof Palumed S.A. (FR) 2011-03-02 EP disclosed
US-20090227626-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THERAPEUTIC USE THEREOF PALUMED S.A. (FR) 2009-09-10 US disclosed
EP-1919894-A2 NOVEL POLYQUINOLINE DERIVATIVES AND THE THERAPEUTIC USE THEREOF Palumed SA (FR) 2008-05-14 EP disclosed
WO-2007015017-A2 NOVEL POLYQUINOLINE DERIVATIVES AND THE THERAPEUTIC USE THEREOF PALUMED S.A. (FR) 2007-02-08 WO 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 (2 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-20120277265-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THE THERAPEUTIC USE THEREOF HTT, APP, PSEN1 PDE10A 2625/4885MEN1 1196/4885KMT2A 2836/4885
US-20090227626-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THERAPEUTIC USE THEREOF HTT, UBQLN2, UBQLN1 PDE10A 1162/4885MEN1 1574/4885KMT2A 2671/4885

“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.