SCHEMBL16248105

SCHEMBL16248105

C=Cc1ccc(OC(C)(C)CN(C)C)cn1

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.36

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
SCHEMBL16248103 0.82 ABL1 (0.38) —
SCHEMBL24244752 0.79 TUBB4A (0.34) —
SCHEMBL609721 0.77 CHRNA3 (0.38) MCHR1
SCHEMBL610781 0.77 MCHR1 (0.38) MCHR1
SCHEMBL16248104 0.74 SRD5A1 (0.33) —
SCHEMBL30786097 0.74 HRH3 (0.51) —
SCHEMBL18951811 0.70 TUBB4A (0.51) MCHR1
SCHEMBL31371069 0.70 SCN9A (0.30) —
SCHEMBL16248094 0.70 PPARA (0.55) —
SCHEMBL12036828 0.68 TUBB4A (0.36) —

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-2603500-B1 INHIBITORS OF BRUTON'S TYROSINE KINASE HOFFMANN LA ROCHE (CH) 2014-11-19 — — EP disclosed
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