SCHEMBL4746705

SCHEMBL4746705

CCOC(=O)c1cnc2ccc(C(=O)N(C)C)cc2c1Nc1c(C)cccc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.59
MAPT P10636 6/20 0.59
TP53 P04637 4/20 0.59
KDM4E B2RXH2 4/20 0.58
ALDH1A1 P00352 3/20 0.58
PKM P14618 1/20 0.58
PAX8 Q06710 1/20 0.57
PDE4B Q07343 1/20 0.55
TSHR P16473 2/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.52
GAA P10253 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
LMNA P02545 2/20 0.52
AURKB Q96GD4 2/20 0.52
AURKA O14965 1/20 0.52
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
MC4R P32245 1/20 0.52

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
SCHEMBL4749413 0.91 MAPT (0.62) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL3786112 0.87 CREBBP (0.60) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL4750342 0.85 MAPT (0.58) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL4747116 0.85 PAX8 (0.67) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL4749734 0.83 PAX8 (0.67) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL4749689 0.83 PAX8 (0.64) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL4746514 0.83 PAX8 (0.64) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL4749614 0.82 MAPT (0.72) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL5331640 0.79 MAPT (0.83) CREBBPMAPTTP53KDM4EALDH1A1
SCHEMBL14043041 0.78 MAPT (0.64) CREBBPMAPTTP53KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008119771-A2 QUINOLINE-S-CARBOXYLIC ACID DERIVATIVES AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2008-10-09 WO claimed
WO-2008119771-A2 QUINOLINE-S-CARBOXYLIC ACID DERIVATIVES AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2008-10-09 WO disclosed