SCHEMBL879093

SCHEMBL879093

CCN(CCOC)Cc1cc(-c2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(OC)c2)c2c(N)ncnn12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.43
PDGFRB P09619 1/20 0.43
BRAF P15056 5/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
RIPK1 Q13546 4/20 0.41
RAF1 P04049 4/20 0.40
KIT P10721 1/20 0.39
FLT3 P36888 1/20 0.39
NTRK1 P04629 1/20 0.39
NTRK2 Q16620 1/20 0.39
CSF1R P07333 1/20 0.39
CCNB2 O95067 1/20 0.39
CCNE2 O96020 1/20 0.39
EGFR P00533 1/20 0.39
CDK1 P06493 1/20 0.39
IGF1R P08069 1/20 0.39
MET P08581 1/20 0.39
SRC P12931 1/20 0.39
CCNB1 P14635 1/20 0.39

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
SCHEMBL10290643 0.90 KDR (0.46) KDRPDGFRBBRAFHTR2AHTR2C
SCHEMBL878946 0.90 RET (0.41) BRAFRIPK1RAF1FLT3NTRK1
SCHEMBL878947 0.86 KDR (0.41) KDRBRAFRIPK1KITFLT3
SCHEMBL10290356 0.85 KDR (0.40) KDRPDGFRBBRAFRIPK1KIT
SCHEMBL878924 0.83 KDR (0.42) KDRBRAFRIPK1KITFLT3
SCHEMBL58866 0.82 ACVRL1 (0.54) KDRPDGFRBBRAFHTR2AHTR2C
SCHEMBL90877 0.82 ABL1 (0.46) KDREGFRSRC
SCHEMBL10291001 0.82 AXL (0.40) KDRPDGFRBBRAFHTR2AHTR2C
SCHEMBL878930 0.78 FGFR1 (0.48) KDRPDGFRBRIPK1KITFLT3
SCHEMBL879122 0.78 MCHR1 (0.41) HTR2AHTR2C

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 KDR 41/4885PDGFRB 453/4885BRAF 790/4885

“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.