SCHEMBL878928

SCHEMBL878928

Cc1cccc(NC(=O)Nc2cc(F)c(-c3cc(CN4CCOCC4)n4ncnc(N)c34)cc2F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVRL1 P37023 5/20 0.51
KDR P35968 9/20 0.49
KIT P10721 8/20 0.49
TEK Q02763 1/20 0.49
FLT3 P36888 9/20 0.47
FGFR1 P11362 2/20 0.46
MAPK9 P45984 2/20 0.46
PRKCD Q05655 2/20 0.46
MAP4K2 Q12851 2/20 0.46
MERTK Q12866 1/20 0.46
RET P07949 1/20 0.46
BCR P11274 1/20 0.46
FRK P42685 1/20 0.46
RPS6KA3 P51812 1/20 0.46
DDR1 Q08345 1/20 0.46
TNK1 Q13470 1/20 0.46
RPS6KA1 Q15418 1/20 0.46
MAP3K11 Q16584 1/20 0.46
DDR2 Q16832 1/20 0.46
RPS6KA6 Q9UK32 1/20 0.46

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
SCHEMBL59320 0.95 ACVRL1 (0.51) ACVRL1KDRKITTEKFLT3
SCHEMBL58475 0.91 ACVRL1 (0.50) ACVRL1KDRKITTEKFLT3
SCHEMBL58432 0.91 ACVRL1 (0.51) ACVRL1KDRKITTEKFLT3
SCHEMBL58278 0.91 ACVRL1 (0.54) ACVRL1KDRKITFLT3FGFR1
SCHEMBL58841 0.91 ACVRL1 (0.49) ACVRL1KDRKITTEKFLT3
SCHEMBL58935 0.91 ACVRL1 (0.57) ACVRL1KDRKITTEKFLT3
SCHEMBL57574 0.90 RET (0.52) ACVRL1FLT3FGFR1MAPK9PRKCD
SCHEMBL90954 0.88 ACVRL1 (0.50) ACVRL1KDRKITTEKFLT3
SCHEMBL57906 0.88 ACVRL1 (0.51) ACVRL1KDRKITFLT3FGFR1
SCHEMBL58423 0.87 ACVRL1 (0.52) ACVRL1KDRKITFLT3FGFR1

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 ACVRL1 963/4885KDR 41/4885KIT 1550/4885

“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.