SCHEMBL10937516

SCHEMBL10937516

C/C(=C(\F)c1ccc(C(=O)O)cc1F)c1ccc2c(c1)C1CCC2C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 4/20 0.52
RARB P10826 3/20 0.52
CHRNA1 P02708 1/20 0.41
CHRNG P07510 1/20 0.41
CHRNB1 P11230 1/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
CHRND Q07001 1/20 0.41
CREBBP Q92793 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
SLC6A4 P31645 2/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KMO O15229 1/20 0.35
RORC P51449 6/20 0.33

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
SCHEMBL10934691 0.87 RARG (0.43) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL10934712 0.87 RARG (0.43) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL10938498 0.85 RARG (0.62) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL10938499 0.85 RARG (0.62) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL10938507 0.85 RARG (0.62) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL1782039 0.79 RARG (0.66) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL1422581 0.79 RARG (0.66) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL1782019 0.79 RARG (0.66) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL10935208 0.78 RARG (0.54) RARGRARBCHRNA1CHRNGCHRNB1
SCHEMBL10934181 0.76 RARG (0.68) RARGRARBCHRNA1CHRNGCHRNB1

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-0155940-A1 BENZONORBORNENYL, BENZOPYRANYL AND BENZOTHIOPYRANYL RETINOIC ACID ANALOGUES SRI INTERNATIONAL (US) 1985-10-02 EP disclosed
WO-1985000806-A1 BENZONORBORNENYL, BENZOPYRANYL AND BENZOTHIOPYRANYL RETINOIC ACID ANALOGUES SRI INTERNATIONAL (US) 1985-02-28 WO disclosed