SCHEMBL9092976

SCHEMBL9092976

CCCN(Cc1ccc(Oc2ccccc2)cc1)C(=O)C1C(C(=O)O)C(C(=O)OCOC(=O)CC)C1C(=O)N(CCC)Cc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 2/20 0.42
▸ LPAR5 Q9H1C0 2/20 0.42

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
SCHEMBL9094275 1.00 LPAR1 (0.42) LPAR1LPAR5
SCHEMBL9094217 0.97 LPAR1 (0.44) LPAR1LPAR5
SCHEMBL9096114 0.97 LPAR1 (0.44) LPAR1LPAR5
SCHEMBL9094109 0.93 LPAR1 (0.42) LPAR1LPAR5
SCHEMBL9094114 0.93 LPAR1 (0.42) LPAR1LPAR5
SCHEMBL9094814 0.90 LPAR1 (0.41) LPAR1LPAR5
SCHEMBL9092867 0.90 LPAR1 (0.44) LPAR1LPAR5
SCHEMBL9092863 0.90 LPAR1 (0.44) LPAR1LPAR5
SCHEMBL9094945 0.90 LPAR1 (0.45) LPAR1LPAR5
SCHEMBL9094949 0.90 LPAR1 (0.45) LPAR1LPAR5

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
WO-1996034850-A1 CYCLOBUTANE DERIVATIVES AND THEIR USE AS INHIBITORS OF PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1996-11-07 — — WO disclosed
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