SCHEMBL841042

SCHEMBL841042

Nc1ncnn2c(C3CCCCN3C(=O)CO)cc(-c3cc(F)c(NC(=O)Nc4cc(C(F)(F)F)ccc4F)cc3F)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.44
FLT3 P36888 4/20 0.44
MAPK9 P45984 4/20 0.44
RPS6KA3 P51812 4/20 0.44
FRK P42685 3/20 0.44
MAP4K2 Q12851 3/20 0.44
RET P07949 2/20 0.44
PRKCD Q05655 2/20 0.44
BCR P11274 1/20 0.44
DDR1 Q08345 1/20 0.44
TNK1 Q13470 1/20 0.44
RPS6KA1 Q15418 1/20 0.44
MAP3K11 Q16584 1/20 0.44
DDR2 Q16832 1/20 0.44
RPS6KA6 Q9UK32 1/20 0.44
CSF1R P07333 5/20 0.41
FLT1 P17948 5/20 0.41
GSK3B P49841 4/20 0.41
KIT P10721 4/20 0.41
GSK3A P49840 3/20 0.41

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
SCHEMBL60193 0.86 TYRO3 (0.46) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL842543 0.83 BTK (0.44) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL59179 0.82 RET (0.47) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL59474 0.81 RET (0.45) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL14686302 0.81 TYRO3 (0.49) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL59311 0.81 TYRO3 (0.52) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL58990 0.79 TYRO3 (0.49) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL58989 0.79 RET (0.43) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL58177 0.79 RET (0.51) FGFR1FLT3MAPK9RPS6KA3FRK
SCHEMBL58916 0.78 RET (0.52) FGFR1FLT3MAPK9RPS6KA3FRK

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
US-8143393-B2 Substituted 4-amino-pyrrolotriazine derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER HEALTHCARE LLC (US) 2012-03-27 US disclosed
US-20100063038-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis BAYER HEALTHCARE LLC 2010-03-11 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 (1 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-20100063038-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis CDK4, CDKL4, MKI67 FGFR1 22/4885FLT3 299/4885MAPK9 4120/4885

“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.