SCHEMBL7106913

SCHEMBL7106913

CC1(c2ccc(O)cc2O)CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.42
RARG P13631 2/20 0.42
RARA P10276 1/20 0.40
OPRM1 P35372 3/20 0.40
GLA P06280 1/20 0.40
TSHR P16473 1/20 0.40
ALOX12 P18054 1/20 0.40
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
ENTPD5 O75356 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36

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
SCHEMBL7106142 0.98 RARB (0.40) RARBRARGRARAOPRM1GLA
SCHEMBL10899122 0.86 RARB (0.50) RARBRARGRARAOPRM1GLA
SCHEMBL12733160 0.81 RARB (0.47) RARBRARGRARAOPRM1GLA
SCHEMBL17877422 0.80 ESR1 (0.42) OPRM1ESR1ESR2ALDH1A1MAPT
SCHEMBL6492178 0.79 ENTPD5 (0.40) OPRM1ESR1ESR2ENTPD5OPRD1
SCHEMBL2213384 0.78 RARB (0.42) RARBRARGRARAOPRM1GLA
SCHEMBL24666355 0.76 ESR1 (0.38) OPRM1ESR1ESR2ENTPD5ALDH1A1
SCHEMBL29820150 0.76 ESR1 (0.38) OPRM1ESR1ESR2ENTPD5ALDH1A1
SCHEMBL7211111 0.75 CYP3A4 (0.44) OPRM1ESR1ESR2ALDH1A1MAPT
SCHEMBL29911088 0.75 CYP3A4 (0.44) OPRM1ESR1ESR2ALDH1A1MAPT

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