SCHEMBL10936673

SCHEMBL10936673

C/C(=C\c1ccc(C(=O)O)cc1)c1cc2c(cc1C)C1CCC2C1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARG P13631 19/20 0.73
RARB P10826 18/20 0.73
RARA P10276 14/20 0.57
RXRA P19793 8/20 0.57
RXRB P28702 3/20 0.57
RXRG P48443 3/20 0.57
ALDH1A1 P00352 2/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
CYP26A1 O43174 1/20 0.44
GMNN O75496 1/20 0.44
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
NFKB1 P19838 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL10936681 1.00 RARG (0.73) RARGRARBRARARXRARXRB
SCHEMBL10936685 1.00 RARG (0.73) RARGRARBRARARXRARXRB
SCHEMBL10938906 0.84 RARG (0.53) RARGRARBRARARXRARXRB
SCHEMBL10938922 0.84 RARG (0.53) RARGRARBRARARXRARXRB
SCHEMBL10938913 0.84 RARG (0.53) RARGRARBRARARXRARXRB
SCHEMBL10933004 0.84 RARG (1.00) RARGRARBRARARXRAALDH1A1
SCHEMBL10934599 0.84 RARG (1.00) RARGRARBRARARXRAALDH1A1
SCHEMBL10936000 0.83 RARG (0.51) RARGRARBRARARXRARXRB
SCHEMBL10936009 0.83 RARG (0.51) RARGRARBRARARXRARXRB
SCHEMBL9442830 0.83 RARG (0.63) RARGRARBRARARXRARXRB

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