SCHEMBL9643301

SCHEMBL9643301

CCCCCCOc1c(OC)c(OC)c(OC(=O)C(C)(C)C)c2cc(C)c(C)cc12

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 3/20 0.41
▸ THRB P10828 3/20 0.41
▸ ESR1 P03372 1/20 0.36
▸ PLA2G2A P14555 1/20 0.36
▸ S1PR2 O95136 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ S1PR3 Q99500 1/20 0.36
▸ LPAR2 Q9HBW0 1/20 0.36
▸ ALOX5 P09917 2/20 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
SCHEMBL9642981 0.84 CNR2 (0.39) PLA2G2A
SCHEMBL9643238 0.84 CNR2 (0.39) PLA2G2A
SCHEMBL9642125 0.83 THRA (0.43) THRATHRBESR1PLA2G2AS1PR2
SCHEMBL9643222 0.83 ABCB11 (0.39) —
SCHEMBL9642611 0.83 ABCB11 (0.39) —
SCHEMBL9643120 0.82 AKR1B1 (0.37) —
SCHEMBL9641883 0.80 THRA (0.36) THRATHRBESR1S1PR2S1PR1
SCHEMBL9641694 0.79 THRA (0.39) THRATHRBESR1
SCHEMBL9642651 0.78 TSHR (0.44) THRATHRB
SCHEMBL9643389 0.76 ABCB11 (0.56) —

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-0215622-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS AND PROCESS FOR MAKING THEM SYNTEX (U.S.A.) INC. (US) 1992-06-17 — — EP disclosed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 — — US disclosed
US-4792556-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-12-20 — — US disclosed
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 — — EP disclosed
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