SCHEMBL4247686

SCHEMBL4247686

CCC(=O)N(Cc1ccc2c(c1)CCCO2)Cc1cc2cc(C)cc(C)c2[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.54
HPGD P15428 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
ALDH1A1 P00352 12/20 0.49
HSD17B10 Q99714 7/20 0.49
USP2 O75604 2/20 0.46
PKM P14618 1/20 0.46
HTT P42858 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
CASP1 P29466 1/20 0.45
MAPK1 P28482 1/20 0.45
MAPT P10636 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL4251806 0.89 KDM4E (0.59) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL5448947 0.87 KDM4E (0.66) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL5443445 0.80 KDM4E (0.56) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL4070699 0.79 ALDH1A1 (0.55) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL23149478 0.78 GUSB (0.61) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL30966039 0.78 GUSB (0.61) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL4075906 0.78 PKM (0.58) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL4081693 0.78 GUSB (0.60) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL4077900 0.78 KDM4E (0.55) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL4073364 0.78 ALDH1A1 (0.56) KDM4EHPGDMEN1KMT2AALDH1A1

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
EP-2040711-A2 2-OXO-1,2-DIHYDROQUINOLINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS Amphora Discovery Corporation (US) 2009-04-01 EP claimed
WO-2007136592-A2 2-0X0-L,2-DIHYDR0QUIN0LINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS AMPHORA DISCOVERY CORPORATION (US) 2007-11-29 WO claimed