SCHEMBL7106142

SCHEMBL7106142

CC1(c2ccc(O)cc2O)CCCC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.40
RARG P13631 2/20 0.40
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
RARA P10276 1/20 0.38
OPRM1 P35372 3/20 0.38
ENTPD5 O75356 2/20 0.38
GLA P06280 1/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37

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
SCHEMBL7106913 0.98 RARB (0.42) RARBRARGESR1ESR2RARA
SCHEMBL10899122 0.84 RARB (0.50) RARBRARGESR1ESR2RARA
SCHEMBL6492178 0.80 ENTPD5 (0.40) ESR1ESR2OPRM1ENTPD5OPRD1
SCHEMBL12733160 0.79 RARB (0.47) RARBRARGESR1ESR2RARA
SCHEMBL17877422 0.78 ESR1 (0.42) ESR1ESR2OPRM1ALDH1A1
SCHEMBL24666355 0.77 ESR1 (0.38) ESR1ESR2OPRM1ENTPD5ALDH1A1
SCHEMBL29820150 0.77 ESR1 (0.38) ESR1ESR2OPRM1ENTPD5ALDH1A1
SCHEMBL7211111 0.77 CYP3A4 (0.44) ESR1ESR2OPRM1ALDH1A1LMNA
SCHEMBL29911088 0.77 CYP3A4 (0.44) ESR1ESR2OPRM1ALDH1A1LMNA
SCHEMBL2213384 0.75 RARB (0.42) RARBRARGESR1ESR2RARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0904774-B1 Resorcinol derivatives PFIZER PROD INC (US) 2003-03-26 EP disclosed
US-6132740-A SKIN LIGHTENING AGENTS; TYROSINASE INHIBITORS; ANTIINFLAMMATORY AGENTS; 4-CYCLOPENTYL- OR CYCLOPENTENYLRESORCINOLS PFIZER INC. (US) 2000-10-17 US disclosed
WO-1999015148-A1 RESORCINOL DERIVATIVES PFIZER PRODUCTS INC. (US) 1999-04-01 WO disclosed
EP-0904774-A1 Resorcinol derivatives Pfizer Products Inc. (US) 1999-03-31 EP disclosed