SCHEMBL279744

SCHEMBL279744

CCc1c(C)c2c(N)ncnn2c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.40
FGFR3 P22607 3/20 0.40
ACVRL1 P37023 9/20 0.37
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
ADORA2A P29274 2/20 0.36
CDC7 O00311 1/20 0.34
DBF4 Q9UBU7 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PLK4 O00444 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
ROCK2 O75116 1/20 0.33
PAK4 O96013 1/20 0.33
CHEK2 O96017 1/20 0.33
ABL1 P00519 1/20 0.33
NTRK1 P04629 1/20 0.33
INSR P06213 1/20 0.33
LCK P06239 1/20 0.33

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
SCHEMBL279610 0.85 FGFR1 (0.39) FGFR1FGFR3ACVRL1ADORA2APLK4
SCHEMBL279164 0.85 FGFR1 (0.49) FGFR1FGFR3ACVRL1
SCHEMBL279403 0.85 FGFR1 (0.39) FGFR1FGFR3ACVRL1ADORA2APLK4
SCHEMBL279415 0.80 FGFR1 (0.39) FGFR1FGFR3ACVRL1ADORA2APLK4
SCHEMBL279456 0.76 FGFR1 (0.34) FGFR1FGFR3ACVRL1ADORA2APLK4
SCHEMBL10118030 0.75 FGFR1 (0.38) FGFR1FGFR3ACVRL1ADORA2APLK4
SCHEMBL65572 0.73 ACVRL1 (0.45) ACVRL1ADORA2A
SCHEMBL15020407 0.73 FGFR1 (0.47) FGFR1FGFR3ACVRL1
SCHEMBL10118032 0.72 RET (0.37) FGFR1FGFR3ACVRL1ADORA2APLK4
SCHEMBL279494 0.72 FGFR1 (0.37) FGFR1FGFR3ACVRL1ADORA2APLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829185-B2 Substituted 4-amino-pyrrolotriazine derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER HEALTHCARE LLC (US) 2014-09-09 US disclosed
US-20120165314-A1 SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS BAYER HEALTHCARE LLC (US) 2012-06-28 US disclosed
US-8133995-B2 Substituted 4-amino-pyrrolotriazine derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER HEALTHCARE LLC (US) 2012-03-13 US disclosed
US-20090281079-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated With Angiogenesis BAYER HEALTHCARE LLV (US) 2009-11-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120165314-A1 SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS CDK4, FLT4, CDKL4 FGFR1 19/4885FGFR3 284/4885ACVRL1 1003/4885
US-20090281079-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated With Angiogenesis CDK4, FLT4, CDKL4 FGFR1 19/4885FGFR3 284/4885ACVRL1 1003/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.