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SCHEMBL8493607

SCHEMBL8493607

CCCN(Cc1ccc(Oc2ccccc2)cc1)C(=O)[C@H]1[C@@H](C(=O)C=[N+]=[N-])[C@H](C(=O)C=[N+]=[N-])[C@@H]1C(=O)N(CCC)Cc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 5/20 0.44
▸ LPAR5 Q9H1C0 5/20 0.44

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
SCHEMBL8493608 1.00 LPAR1 (0.44) LPAR1LPAR5
SCHEMBL8498460 0.94 LPAR1 (0.43) LPAR1LPAR5
SCHEMBL8498458 0.94 LPAR1 (0.43) LPAR1LPAR5
SCHEMBL8494932 0.84 LPAR1 (0.51) LPAR1LPAR5
SCHEMBL8493183 0.84 LPAR1 (0.51) LPAR1LPAR5
SCHEMBL8493801 0.84 LPAR1 (0.51) LPAR1LPAR5
SCHEMBL8493909 0.84 LPAR1 (0.51) LPAR1LPAR5
SCHEMBL4959382 0.84 LPAR1 (0.51) LPAR1LPAR5
SCHEMBL8825925 0.84 LPAR1 (0.51) LPAR1LPAR5
SCHEMBL4959388 0.84 LPAR1 (0.51) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0677039-B1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LAB (US) 1999-03-10 — — EP disclosed
WO-1996034850-A1 CYCLOBUTANE DERIVATIVES AND THEIR USE AS INHIBITORS OF PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1996-11-07 — — WO disclosed
EP-0677039-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE Abbott Laboratories (US) 1995-10-18 — — EP disclosed
WO-1995012572-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1995-05-11 — — WO disclosed
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