SCHEMBL3409748

SCHEMBL3409748

CC(C)Oc1ccc(NC(=O)[C@@H]2CC[C@@H]3CC[C@H]2N3C(=O)OC(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ELOVL6 Q9H5J4 18/20 0.56
ELOVL3 Q9HB03 1/20 0.45
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
TP53 P04637 1/20 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
SCHEMBL2889042 0.87 ELOVL6 (0.62) ELOVL6ELOVL3TP53
SCHEMBL2889039 0.87 ELOVL6 (0.62) ELOVL6ELOVL3TP53
SCHEMBL2891035 0.74 ELOVL6 (0.70) ELOVL6ELOVL3
SCHEMBL2891037 0.74 ELOVL6 (0.70) ELOVL6ELOVL3
SCHEMBL2883519 0.74 ELOVL6 (0.70) ELOVL6ELOVL3
SCHEMBL2883518 0.74 ELOVL6 (0.70) ELOVL6ELOVL3
SCHEMBL16150873 0.73 JAK2 (0.41) PTPN2PTPN1PTPN6
SCHEMBL792679 0.73 CHRM2 (0.57)
SCHEMBL30994163 0.73 CHRM2 (0.57)
SCHEMBL2890236 0.73 CHRM2 (0.57)

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-2261210-A1 3-SUBSTITUTED SULFONYL PIPERAZINE DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-12-15 EP disclosed