SCHEMBL7982381

SCHEMBL7982381

O=c1oc2ccccc2c2ccc(O)c(O)c12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.57
ESR1 P03372 2/20 0.55
ESR2 Q92731 2/20 0.55
KDM4E B2RXH2 4/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
CYP3A4 P08684 4/20 0.53
MAPT P10636 3/20 0.53
PKM P14618 3/20 0.53
RECQL P46063 3/20 0.53
HSD17B10 Q99714 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
HPGD P15428 2/20 0.53
BLM P54132 2/20 0.53
ALPI P09923 1/20 0.53
GAA P10253 1/20 0.53
CASP3 P42574 1/20 0.53
CASP7 P55210 1/20 0.53
CASP6 P55212 1/20 0.53
MCL1 Q07820 1/20 0.53

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
SCHEMBL9749884 0.82 LMNA (0.50) PTGS2ESR1ESR2KDM4EMEN1
SCHEMBL4395024 0.82 MAOA (0.66) KDM4EMEN1KMT2ACYP3A4MAPT
SCHEMBL1445004 0.77 MAOA (0.69) PTGS2KDM4EMEN1KMT2ACYP3A4
SCHEMBL29633014 0.77 MAOA (0.69) PTGS2KDM4EMEN1KMT2ACYP3A4
SCHEMBL7984298 0.77 ESR2 (0.75) PTGS2ESR1ESR2KDM4ECYP3A4
SCHEMBL1179868 0.76 MAOA (0.52) PTGS2KDM4EMEN1KMT2ACYP3A4
SCHEMBL30900701 0.75 L3MBTL1 (0.62) KDM4EMEN1KMT2ACYP3A4MAPT
SCHEMBL3881176 0.74 PTGS2 (0.74) PTGS2KDM4EMEN1KMT2ACYP3A4
SCHEMBL17384091 0.74 TDP1 (0.67) KDM4EMEN1KMT2ACYP3A4MAPT
SCHEMBL29872 0.74 KDM4E (0.69) KDM4EMEN1KMT2ACYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed