SCHEMBL12513707

SCHEMBL12513707

Cn1ccc2c(Br)cnc(Br)c21

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 1/20 0.30

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
SCHEMBL31083207 0.85 PIK3CB (0.30) PIK3CB
SCHEMBL3989639 0.85 PIK3CB (0.30) PIK3CB
SCHEMBL19100879 0.79 ALDH1A1 (0.31) —
SCHEMBL16439846 0.79 CHRNB2 (0.34) —
SCHEMBL20155269 0.74 F2RL1 (0.31) —
SCHEMBL31083085 0.74 PIK3CB (0.35) PIK3CB
SCHEMBL20154949 0.72 ALDH1A1 (0.34) —
SCHEMBL30219113 0.68 KDM4E (0.33) —
SCHEMBL13994243 0.67 MGLL (0.35) —
SCHEMBL30702049 0.67 NFATC1 (0.36) PIK3CB

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-1638568-B1 INDOLE, AZAINDOLE AND RELATED HETEROCYCLIC N-SUBSTITUTED PIPERAZINE DERIVATIVES BRISTOL MYERS SQUIBB CO (US) 2011-07-27 — — EP disclosed
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