SCHEMBL17181882

SCHEMBL17181882

CN1CCCN(Cc2ccc(NC(=O)Cc3cccc(C#Cc4cnc(N)nc4-c4cc5c(n4C)CCNC5=O)c3)cc2C(F)(F)F)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 6/20 0.49
▸ ABL1 P00519 8/20 0.46
▸ FGFR1 P11362 4/20 0.46
▸ KDR P35968 1/20 0.46
▸ RET P07949 3/20 0.45
▸ KIF5B P33176 1/20 0.44
▸ CCDC6 Q16204 1/20 0.44
▸ CDK8 P49336 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ FLT3 P36888 1/20 0.42
▸ LRRK2 Q5S007 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ BCR P11274 1/20 0.42

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
SCHEMBL17181912 0.98 KIT (0.51) KITABL1FGFR1KDRRET
SCHEMBL17182098 0.96 KIT (0.45) KITABL1FGFR1KDRRET
SCHEMBL17182124 0.94 KIT (0.46) KITABL1FGFR1KDRRET
SCHEMBL15687882 0.94 KIT (0.45) KITABL1FGFR1KDRRET
SCHEMBL17182179 0.94 KIT (0.45) KITABL1FGFR1KDRRET
SCHEMBL17181860 0.94 KIT (0.45) KITABL1FGFR1KDRRET
Hydrochloric Acid SCHEMBL17182168 0.94 KIT (0.45) KITABL1FGFR1KDRRET
SCHEMBL17181840 0.93 ABL1 (0.49) KITABL1FGFR1KDRRET
SCHEMBL15688048 0.93 KIT (0.44) KITABL1FGFR1KDRRET
SCHEMBL17181861 0.92 KIT (0.44) KITABL1FGFR1KDRRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2917214-B1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2019-08-28 — — EP claimed
US-9604980-B2 Substituted pyrimidinyl and pyridinyl-pyrrolopyridinones, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-03-28 — — US claimed
US-20150299192-A1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-10-22 — — US claimed
EP-2917214-B1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2019-08-28 — — EP disclosed
US-9604980-B2 Substituted pyrimidinyl and pyridinyl-pyrrolopyridinones, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-03-28 — — US disclosed
US-20150299192-A1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-10-22 — — 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-20150299192-A1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS RET, MAP3K8, MAP3K1 KIT 463/4885ABL1 35/4885FGFR1 355/4885

“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.

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