SCHEMBL8084785

SCHEMBL8084785

CC1CCC(C(C)C)C(Oc2ccc(CC(=O)O)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.56
SERPINE1 P05121 3/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 1/20 0.45
P2RX4 Q99571 1/20 0.44
TRPV1 Q8NER1 2/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL8436679 0.83 SERPINE1 (0.53) CYP19A1SERPINE1ALDH1A1HPGDLMNA
SCHEMBL8432260 0.83 SERPINE1 (0.53) CYP19A1SERPINE1ALDH1A1HPGDLMNA
SCHEMBL7992980 0.83 SERPINE1 (0.53) CYP19A1SERPINE1ALDH1A1HPGDLMNA
SCHEMBL30817871 0.81 CYP19A1 (0.64) CYP19A1SERPINE1ALDH1A1HPGDLMNA
SCHEMBL16287694 0.80 CYP19A1 (0.45) CYP19A1SERPINE1ALDH1A1HPGDLMNA
SCHEMBL28983174 0.80 ALDH1A1 (0.51) CYP19A1SERPINE1ALDH1A1HPGDLMNA
SCHEMBL12760812 0.80 ALDH1A1 (0.46) CYP19A1ALDH1A1HPGDLMNAP2RX4
SCHEMBL8984221 0.80 ALDH1A1 (0.58) CYP19A1ALDH1A1HPGDLMNAP2RX4
SCHEMBL28381197 0.80 ALDH1A1 (0.58) CYP19A1ALDH1A1HPGDLMNAP2RX4
SCHEMBL7945461 0.79 TRPM8 (0.48) CYP19A1SERPINE1ALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed