SCHEMBL4045067

SCHEMBL4045067

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

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ MAPT P10636 4/20 0.47
▸ HTT P42858 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ NAMPT P43490 2/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ TP53 P04637 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ PANK3 Q9H999 1/20 0.43
▸ CSNK1E P49674 6/20 0.43
▸ POLB P06746 1/20 0.42
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ FAAH O00519 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
SCHEMBL13964334 0.92 CSNK1E (0.50) SMN1; SMN2MAPK1RAB9AMAPTHTT
SCHEMBL4047956 0.90 NPC1 (0.52) RAB9AMAPTHTTKDM4ELMNA
SCHEMBL4041559 0.86 CSNK1E (0.49) CSNK1E
SCHEMBL14368407 0.83 NPC1 (0.50) RAB9AKDM4ECSNK1EPOLB
SCHEMBL14368388 0.82 CSNK1E (0.53) CSNK1E
SCHEMBL13963918 0.82 CSNK1E (0.52) SMN1; SMN2RAB9ANAMPTALDH1A1CSNK1E
SCHEMBL14368412 0.82 CSNK1E (0.51) SMN1; SMN2RAB9AMAPTLMNATP53
SCHEMBL13964269 0.81 NAMPT (0.49) KDM4ENAMPTCSNK1EPOLB
SCHEMBL14368531 0.81 CSNK1E (0.50) CSNK1E
SCHEMBL14368398 0.80 CSNK1E (0.52) SMN1; SMN2RAB9AMAPTPANK3CSNK1E

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 4 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-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

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 SMN1; SMN2 3785/4885MAPK1 5/4885RAB9A 2046/4885
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents CNKSR1, ROS1, NRAS SMN1; SMN2 4434/4885MAPK1 16/4885RAB9A 1590/4885

“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.

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