SCHEMBL4037798

SCHEMBL4037798

CCOC(=O)c1ccc(NC(=O)N2CCn3c(c(C(N)=O)c(Cl)c3-c3ccccc3)C2)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.55
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 4/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CSNK1E P49674 6/20 0.49
MAPT P10636 3/20 0.48
KDM4E B2RXH2 1/20 0.48
HTT P42858 1/20 0.48
HSD17B10 Q99714 1/20 0.48
GAA P10253 1/20 0.47
P2RY12 Q9H244 2/20 0.46

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
SCHEMBL4038686 0.91 MAPT (0.48) MAPK1MEN1KMT2ACSNK1EMAPT
SCHEMBL4220262 0.90 KMT2A (0.47) MAPK1MEN1KMT2AALDH1A1RAB9A
SCHEMBL4213339 0.87 MEN1 (0.53) MAPK1MEN1KMT2AALDH1A1RAB9A
SCHEMBL13964334 0.87 CSNK1E (0.50) MAPK1RAB9ASMN1; SMN2CSNK1EMAPT
SCHEMBL4041559 0.87 CSNK1E (0.49) CSNK1E
SCHEMBL13963918 0.87 CSNK1E (0.52) ALDH1A1RAB9ANPC1SMN1; SMN2CSNK1E
SCHEMBL14368388 0.86 CSNK1E (0.53) CSNK1E
SCHEMBL14368412 0.85 CSNK1E (0.51) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL14368386 0.85 CSNK1E (0.53) RAB9ANPC1CSNK1EMAPT
SCHEMBL14368531 0.84 CSNK1E (0.50) CSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1436291-B1 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA SA (FR) 2009-01-14 EP disclosed
US-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 US disclosed
US-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 US disclosed
US-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 US disclosed
US-7148215-B2 Prodrugs as antihistamines or anticarcinogenic agents AVENTIS PHARMA S.A. (FR) 2006-12-12 US disclosed
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents AVENTIS PHARMA S.A, (FR) 2005-01-13 US disclosed
EP-1436291-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS Aventis Pharma S.A. (FR) 2004-07-14 EP disclosed
WO-2003024967-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA S.A. (FR) 2003-03-27 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-20070238734-A1 JNK INHIBITORS MAP3K7, MAPKAPK2, MAPK7 MAPK1 5/4885MEN1 3865/4885KMT2A 2686/4885
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents CNKSR1, ROS1, NRAS MAPK1 16/4885MEN1 3716/4885KMT2A 1910/4885

“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.