SCHEMBL10933004

SCHEMBL10933004

C/C(=C/c1ccc(C(=O)O)cc1)c1ccc2c(c1)C1CCC2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARG P13631 18/20 1.00
▸ RARB P10826 17/20 1.00
▸ RARA P10276 15/20 0.52
▸ RXRA P19793 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ CYP26A1 O43174 1/20 0.52
▸ GMNN O75496 1/20 0.52
▸ USP2 O75604 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ THPO P40225 1/20 0.52
▸ MTOR P42345 1/20 0.52

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
SCHEMBL10934599 1.00 RARG (1.00) RARGRARBRARARXRAALDH1A1
SCHEMBL9442874 0.87 RARG (0.78) RARGRARBRARARXRAALDH1A1
SCHEMBL9442877 0.87 RARG (0.78) RARGRARBRARARXRAALDH1A1
SCHEMBL10936477 0.84 RARG (0.72) RARGRARBRARARXRAALDH1A1
SCHEMBL10936673 0.84 RARG (0.73) RARGRARBRARARXRAALDH1A1
SCHEMBL10936681 0.84 RARG (0.73) RARGRARBRARARXRAALDH1A1
SCHEMBL10936685 0.84 RARG (0.73) RARGRARBRARARXRAALDH1A1
SCHEMBL10932960 0.84 RARG (0.72) RARGRARBRARARXRAALDH1A1
SCHEMBL10932962 0.84 RARG (0.72) RARGRARBRARARXRAALDH1A1
SCHEMBL10932952 0.84 RARG (0.72) RARGRARBRARARXRAALDH1A1

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
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