SCHEMBL10337092

SCHEMBL10337092

CCC(C)Oc1c(OC(C)CC)c(OC(=O)CCC(C)I)c2cc(Cl)ccc2c1OC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.50
MAPT P10636 1/20 0.30
DHODH Q02127 1/20 0.30

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
SCHEMBL9643015 0.88 ABCB11 (0.63) ABCB11MAPTDHODH
SCHEMBL9642245 0.85 ABCB11 (0.54) ABCB11MAPTDHODH
SCHEMBL10337090 0.85 ABCB11 (0.54) ABCB11MAPTDHODH
SCHEMBL9642915 0.82 ABCB11 (0.49) ABCB11MAPTDHODH
SCHEMBL9643064 0.81 ABCB11 (0.54) ABCB11MAPTDHODH
SCHEMBL9642690 0.81 ABCB11 (0.54) ABCB11MAPTDHODH
SCHEMBL9643105 0.81 ABCB11 (0.54) ABCB11DHODH
SCHEMBL9641821 0.81 ABCB11 (0.54) ABCB11DHODH
SCHEMBL9642402 0.77 ABCB11 (0.55) ABCB11DHODH
SCHEMBL9643104 0.77 ABCB11 (0.55) ABCB11DHODH

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
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