SCHEMBL8522835

SCHEMBL8522835

CC=Cc1c(C(=O)O)ccc(-c2ccc(O)cc2)c1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.39
RARB P10826 4/20 0.38
PTPN11 Q06124 4/20 0.36
NR0B2 Q15466 2/20 0.36
RARA P10276 3/20 0.34
RARG P13631 2/20 0.34
SERPINE1 P05121 2/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
EPHX2 P34913 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8322245 0.74 RARB (0.52) HSD17B10RARBPTPN11NR0B2RARA
SCHEMBL9161924 0.70 RARA (0.47) HSD17B10RARBRARARARGMEN1
SCHEMBL8149907 0.69 KDM4E (0.45) RARBRARARARGSERPINE1EPHX2
SCHEMBL8522832 0.65 RARB (0.52) HSD17B10RARBPTPN11NR0B2RARA
SCHEMBL15200898 0.65 PTPN11 (0.65) RARBPTPN11NR0B2RARARARG
SCHEMBL5834020 0.65 KDM4E (0.51) HSD17B10SERPINE1MAPTKMT2AEPHX2
SCHEMBL15766044 0.65 SELL (0.47) HSD17B10RARBRARARARGSERPINE1
SCHEMBL18040210 0.65 SELL (0.47) HSD17B10RARBRARARARGSERPINE1
SCHEMBL4553304 0.64 HNF4A (0.51) HSD17B10KDM4EALDH1A1HPGD
SCHEMBL18040209 0.63 KDM4E (0.49) HSD17B10RARBRARARARGSERPINE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5942531-A Phenolic/naphtholic retinoids for promoting skin/exoskeleton pigmentation CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 1999-08-24 US disclosed