SCHEMBL4615977

SCHEMBL4615977

CC(C)[CH]c1ncccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 20/20 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
SCHEMBL20086551 0.82 NFE2L2 (0.51) NFE2L2
SCHEMBL2894721 0.77
SCHEMBL6758747 0.73 NFE2L2 (0.46) NFE2L2
SCHEMBL18215455 0.73 NFE2L2 (0.54) NFE2L2
SCHEMBL20091022 0.73 NFE2L2 (0.46) NFE2L2
SCHEMBL1134027 0.72
SCHEMBL29935498 0.72
SCHEMBL5974760 0.72
SCHEMBL9000351 0.71 NFE2L2 (0.56) NFE2L2
SCHEMBL20090979 0.71 NFE2L2 (0.44) NFE2L2

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-1556354-B1 THERAPEUTIC PIPERAZINE DERIVATES USEFUL FOR TREATING PAIN EURO CELTIQUE SA (LU) 2008-01-23 EP disclosed