SCHEMBL249390

SCHEMBL249390

CCC(C)c1cccc(C(C)C)c1OC(=O)NC(C)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CASR P41180 1/20 0.45

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
SCHEMBL3435870 1.00 MEN1 (0.48) MEN1KMT2ACASR
SCHEMBL3435521 1.00 MEN1 (0.48) MEN1KMT2ACASR
SCHEMBL10033208 0.96 MEN1 (0.51) MEN1KMT2ACASR
SCHEMBL560467 0.96 MEN1 (0.51) MEN1KMT2ACASR
SCHEMBL17972913 0.82 MEN1 (0.45) MEN1KMT2A
SCHEMBL28369492 0.82 MEN1 (0.45) MEN1KMT2A
SCHEMBL17533339 0.81 EPHX1 (0.44)
SCHEMBL17533351 0.81 EPHX1 (0.44)
SCHEMBL17533347 0.81 EPHX1 (0.44)
SCHEMBL17533286 0.81 EPHX1 (0.44)

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
EP-2152651-B1 THERAPEUTIC COMPOUNDS PHARMACOFORE INC (US) 2012-01-04 EP disclosed