SCHEMBL27768153

SCHEMBL27768153

[CH2]CCCc1cc(Br)c2c(N)ncnn12

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACVRL1 P37023 10/20 0.47
PIK3CD O00329 7/20 0.35
CSNK2A2 P19784 2/20 0.31
CSNK2A1 P68400 2/20 0.31
NTRK1 P04629 1/20 0.31
NTRK2 Q16620 1/20 0.31

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
SCHEMBL59811 0.87 ACVRL1 (0.48) ACVRL1PIK3CDNTRK1NTRK2
SCHEMBL16021414 0.85 ACVRL1 (0.50) ACVRL1PIK3CDNTRK1NTRK2
SCHEMBL5076725 0.85 ACVRL1 (0.49) ACVRL1PIK3CDNTRK1NTRK2
SCHEMBL59980 0.85 ACVRL1 (0.63) ACVRL1PIK3CD
SCHEMBL14700063 0.85 ACVRL1 (0.47) ACVRL1PIK3CDNTRK1NTRK2
SCHEMBL5136418 0.84 ACVRL1 (0.64) ACVRL1PIK3CD
SCHEMBL59716 0.82 ACVRL1 (0.52) ACVRL1PIK3CDCSNK2A2CSNK2A1
SCHEMBL16011258 0.82 ACVRL1 (0.59) ACVRL1PIK3CD
SCHEMBL27747182 0.79 ACVRL1 (0.65) ACVRL1PIK3CD
SCHEMBL5077805 0.79 ACVRL1 (0.44) ACVRL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101466710-B Substituted 4-amino-pyrrolotriazine derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER HEALTHCARE LLC 2013-05-29 CN disclosed
CN-101466710-A Substituted 4-amino-pyrrolotriazine derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER HEALTHCARE LLC (US) 2009-06-24 CN disclosed