SCHEMBL8692801

SCHEMBL8692801

CCCN(Cc1ccc(Oc2ccccc2)cc1)C(=O)C1CC(C(=O)OC(C)CC)C1C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 2/20 0.40
▸ LPAR5 Q9H1C0 2/20 0.40
▸ PTGES O14684 1/20 0.37

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
SCHEMBL8692770 0.93 LPAR1 (0.41) LPAR1LPAR5PTGES
SCHEMBL8696952 0.88 LPAR1 (0.40) LPAR1LPAR5PTGES
SCHEMBL8695447 0.88 LPAR1 (0.38) LPAR1LPAR5PTGES
SCHEMBL8691477 0.88 LPAR1 (0.45) LPAR1LPAR5
SCHEMBL8691589 0.87 LPAR1 (0.41) LPAR1LPAR5
SCHEMBL8691812 0.87 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8694285 0.87 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8698291 0.87 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8692615 0.87 LPAR1 (0.40) LPAR1LPAR5PTGES
SCHEMBL8694760 0.87 LPAR1 (0.37) LPAR1LPAR5PTGES

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5783593-A FUNGICIDE; ANTICHOLESTEROL AGENT ABBOTT LABORATORIES (US) 1998-07-21 — — US disclosed
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