SCHEMBL10225844

SCHEMBL10225844

COCc1c(-c2ccc(NC(=O)Nc3cc(C(F)(F)F)ccc3F)c(F)c2)c2c(N)nncn2c1C1CCN(C(=O)OC(C)(C)C(=O)OC)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.49
FGFR1 P11362 2/20 0.49
RET P07949 2/20 0.49
BCR P11274 1/20 0.49
FRK P42685 1/20 0.49
MAPK9 P45984 1/20 0.49
RPS6KA3 P51812 1/20 0.49
PRKCD Q05655 1/20 0.49
DDR1 Q08345 1/20 0.49
MAP4K2 Q12851 1/20 0.49
TNK1 Q13470 1/20 0.49
RPS6KA1 Q15418 1/20 0.49
MAP3K11 Q16584 1/20 0.49
DDR2 Q16832 1/20 0.49
RPS6KA6 Q9UK32 1/20 0.49
KDR P35968 11/20 0.35
PDGFRB P09619 4/20 0.35
BRAF P15056 6/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL10273340 0.92 RET (0.49) FLT3FGFR1RETBCRFRK
SCHEMBL15435525 0.87 FGFR1 (0.64) FLT3FGFR1RETBCRFRK
SCHEMBL276467 0.82 FGFR1 (0.66) FLT3FGFR1RETBCRFRK
SCHEMBL10225846 0.80 FGFR1 (0.49) FLT3FGFR1RETBCRFRK
SCHEMBL9979888 0.79 FGFR1 (0.63) FLT3FGFR1RETBCRFRK
SCHEMBL5182413 0.78 RET (0.56) FLT3FGFR1RETBCRFRK
SCHEMBL276552 0.78 FGFR1 (0.67) FLT3FGFR1RETBCRFRK
SCHEMBL276616 0.76 FGFR1 (0.69) FLT3FGFR1RETBCRFRK
SCHEMBL279530 0.75 FGFR1 (0.61) FLT3FGFR1RETBCRFRK
SCHEMBL276273 0.74 FGFR1 (0.69) FLT3FGFR1RETBCRFRK

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
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

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-20120165314-A1 SUBSTITUTED 4-AMINO-PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS CDK4, FLT4, CDKL4 FLT3 318/4885FGFR1 19/4885RET 1216/4885

“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.