SCHEMBL30459931

SCHEMBL30459931

FC(F)COc1cncc(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.43
CHRNA4 P43681 3/20 0.43

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
SCHEMBL215266 1.00 CHRNB2 (0.43) CHRNB2CHRNA4
SCHEMBL7102411 0.81 CHRNB2 (0.47) CHRNB2CHRNA4
SCHEMBL188578 0.79 CHRNB2 (0.45) CHRNB2CHRNA4
SCHEMBL26923027 0.79 CHRNB2 (0.45) CHRNB2CHRNA4
SCHEMBL31168037 0.78 SOD1 (0.39)
SCHEMBL30702019 0.78 BACE1 (0.39)
SCHEMBL27191843 0.78 BACE1 (0.39)
SCHEMBL27978363 0.78 CYP1A1 (0.41)
SCHEMBL27978105 0.78 CYP11B1 (0.42) CHRNB2CHRNA4
SCHEMBL15034034 0.78 CHRNB1 (0.43) CHRNB2CHRNA4

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
CN-116457346-A Preparation of indolone derivatives as novel diacylglycerol O-acyltransferase 2 inhibitors 默沙东有限责任公司 2023-07-18 CN disclosed