SCHEMBL6423613

SCHEMBL6423613

COC(=O)c1cc(-c2ccccc2)c(OCc2ccccc2)c(C(C)(C)C)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
LMNA P02545 2/20 0.49
ALDH1A1 P00352 2/20 0.44
CNR1 P21554 1/20 0.44
USP2 O75604 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GABRA1 P14867 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA3 P34903 1/20 0.41
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
KDM4E B2RXH2 1/20 0.40
PTPN1 P18031 1/20 0.39
PDCD1 Q15116 2/20 0.39
CD274 Q9NZQ7 2/20 0.39
PTGER1 P34995 1/20 0.38

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
SCHEMBL6422110 0.79 MAOB (0.46) HSD17B10KDM4EMAPTTDP1
SCHEMBL6422106 0.79 MAOB (0.46) HSD17B10KDM4EMAPTTDP1
SCHEMBL6423841 0.78 ERN1 (0.41) HPGDLMNAMGAMGAASI
SCHEMBL8409192 0.75 LMNA (0.55) HPGDLMNAALDH1A1CNR1USP2
SCHEMBL15726037 0.73 LMNA (0.58) HPGDLMNAALDH1A1USP2TSHR
SCHEMBL30666026 0.73 LMNA (0.56) HPGDLMNAALDH1A1USP2TSHR
SCHEMBL18394067 0.73 HPGD (0.56) HPGDLMNAALDH1A1USP2TSHR
SCHEMBL30666033 0.73 HPGD (0.56) HPGDLMNAALDH1A1USP2TSHR
SCHEMBL18393955 0.73 LMNA (0.56) HPGDLMNAALDH1A1USP2TSHR
SCHEMBL10604980 0.73 LMNA (0.67) HPGDLMNAALDH1A1USP2TSHR

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-1513793-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development, S.N.C. (FR) 2005-03-16 EP disclosed
WO-2003101928-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2003-12-11 WO disclosed