SCHEMBL8694597

SCHEMBL8694597

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

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 2/20 0.41
▸ LPAR5 Q9H1C0 2/20 0.41
▸ HDAC3 O15379 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ NCOR2 Q9Y618 1/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 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
SCHEMBL8696216 0.90 LPAR1 (0.38) LPAR1LPAR5MEN1KMT2A
SCHEMBL8691477 0.89 LPAR1 (0.45) LPAR1LPAR5
SCHEMBL8691812 0.89 LPAR1 (0.46) LPAR1LPAR5MEN1KMT2A
SCHEMBL8698291 0.89 LPAR1 (0.46) LPAR1LPAR5MEN1KMT2A
SCHEMBL8694285 0.89 LPAR1 (0.46) LPAR1LPAR5MEN1KMT2A
SCHEMBL8696604 0.88 LPAR1 (0.42) LPAR1LPAR5
SCHEMBL8692009 0.87 LPAR1 (0.42) LPAR1LPAR5
SCHEMBL8693835 0.86 LPAR1 (0.41) LPAR1LPAR5
SCHEMBL8695186 0.86 LPAR1 (0.41) LPAR1LPAR5
SCHEMBL8692770 0.86 LPAR1 (0.41) 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
US-5783593-A FUNGICIDE; ANTICHOLESTEROL AGENT ABBOTT LABORATORIES (US) 1998-07-21 — — US disclosed
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