SCHEMBL8638845

SCHEMBL8638845

CCCc1c(-c2ccc(O)cc2)oc2cc(O)ccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 3/20 0.56
PTPN1 P18031 5/20 0.56
ACP1 P24666 5/20 0.56
ALDH1A1 P00352 6/20 0.54
KDM4E B2RXH2 6/20 0.54
CYP3A4 P08684 6/20 0.54
HSD17B10 Q99714 6/20 0.54
MAPT P10636 5/20 0.54
CYP2C9 P11712 4/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
CASP1 P29466 3/20 0.54
CASP7 P55210 3/20 0.54
HPGD P15428 3/20 0.54
MAPK1 P28482 3/20 0.54
CYP2C19 P33261 2/20 0.54
TP53 P04637 2/20 0.54
CYP2D6 P10635 1/20 0.54
POLH Q9Y253 1/20 0.48
PPARG P37231 1/20 0.48

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
SCHEMBL8637350 0.91 ALDH1A1 (0.53) HSD17B3PTPN1ACP1ALDH1A1KDM4E
SCHEMBL8635613 0.88 MEN1 (0.54) HSD17B3PTPN1ACP1ALDH1A1KDM4E
SCHEMBL8638914 0.88 PTPN1 (0.58) HSD17B3PTPN1ACP1ALDH1A1KDM4E
SCHEMBL8641732 0.80 PTPN1 (0.51) HSD17B3PTPN1ACP1ALDH1A1KDM4E
SCHEMBL8383149 0.80 HSD17B3 (0.65) HSD17B3ALDH1A1KDM4EHSD17B10CASP1
SCHEMBL8638111 0.79 MEN1 (0.51) HSD17B3PTPN1ACP1ALDH1A1KDM4E
SCHEMBL10794977 0.77 HSD17B3 (0.78) HSD17B3ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9136261 0.76 ALDH1A1 (0.63) HSD17B3PTPN1ACP1ALDH1A1KDM4E
SCHEMBL8636723 0.75 MEN1 (0.56) PTPN1ACP1ALDH1A1KDM4ECYP3A4
SCHEMBL10795213 0.75 HSD17B3 (0.74) HSD17B3ALDH1A1KDM4EHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516257-B1 Phenylbenzo[b]furans and -thiophenes, procedures for their preparation, and pharmaceutical compositions containing the same SCHERING AG (DE) 1998-08-05 EP claimed
WO-1992021669-A1 2-PHENYLBENZO[B]FURANS AND THIOPHENES, METHODS OF PREPARING THEM AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-10 WO claimed
EP-0516257-A1 Phenylbenzo[b]furans and -thiophenes, procedures for their preparation, and pharmaceutical compositions containing the same SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-02 EP claimed
EP-0516257-B1 Phenylbenzo[b]furans and -thiophenes, procedures for their preparation, and pharmaceutical compositions containing the same SCHERING AG (DE) 1998-08-05 EP disclosed
US-5470854-A Antiestrogens SCHERING AKTIENGESELLSCHAFT (DE) 1995-11-28 US disclosed
WO-1992021669-A1 2-PHENYLBENZO[B]FURANS AND THIOPHENES, METHODS OF PREPARING THEM AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-10 WO disclosed
EP-0516257-A1 Phenylbenzo[b]furans and -thiophenes, procedures for their preparation, and pharmaceutical compositions containing the same SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-02 EP disclosed