SCHEMBL10264998

SCHEMBL10264998

Cc1ccc(C(=O)Nc2ccc(CN3CCN(CCO)CC3)c(C(F)(F)F)c2)cc1-c1cnc2ccccn12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 17/20 0.75
▸ ABL2 P42684 1/20 0.73
▸ BCR P11274 1/20 0.68
▸ BRAF P15056 3/20 0.58
▸ EGFR P00533 2/20 0.58
▸ JAK2 O60674 1/20 0.58
▸ RET P07949 1/20 0.58
▸ PDGFRB P09619 1/20 0.58
▸ FGFR1 P11362 1/20 0.58
▸ SRC P12931 1/20 0.58
▸ PDGFRA P16234 1/20 0.58
▸ FLT1 P17948 1/20 0.58
▸ FGFR2 P21802 1/20 0.58
▸ FGFR4 P22455 1/20 0.58
▸ FGFR3 P22607 1/20 0.58
▸ JAK1 P23458 1/20 0.58
▸ CCNE1 P24864 1/20 0.58
▸ CDK2 P24941 1/20 0.58
▸ EPHA2 P29317 1/20 0.58
▸ EPHA3 P29320 1/20 0.58

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
SCHEMBL10265843 0.94 ABL1 (0.75) ABL1ABL2BCRBRAFEGFR
SCHEMBL9610939 0.94 ABL1 (0.76) ABL1ABL2BCRBRAFEGFR
SCHEMBL10265087 0.93 ABL1 (0.75) ABL1ABL2BCR
SCHEMBL15499610 0.93 ABL1 (0.67) ABL1ABL2BCRBRAFEGFR
SCHEMBL9610973 0.91 ABL1 (0.76) ABL1ABL2BCRBRAFEGFR
SCHEMBL10265557 0.91 ABL1 (0.75) ABL1ABL2BCRBRAFEGFR
SCHEMBL10265301 0.91 ABL1 (0.76) ABL1ABL2BCRBRAFEGFR
SCHEMBL9610978 0.91 ABL1 (0.75) ABL1ABL2BCRBRAFEGFR
SCHEMBL10266185 0.91 ABL1 (0.75) ABL1ABL2BCRBRAFEGFR
SCHEMBL9611137 0.89 ABL1 (0.70) ABL1ABL2BCRBRAFEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150105377-A1 Methods and Compositions for RAF Kinase Mediated Diseases ARIAD PHARMACEUTICALS, INC. 2015-04-16 — — US disclosed
US-8114874-B2 Substituted acetylenic imidazo[1,2-B]pyridazine compounds as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2012-02-14 — — US disclosed
US-20070191376-A1 Bicyclic heteroaryl compounds TAKEDA PHARMACEUTICALS U.S.A., INC. 2007-08-16 — — 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 (2 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-20150105377-A1 Methods and Compositions for RAF Kinase Mediated Diseases BRAF, RAF1, NRAS ABL1 75/4885ABL2 231/4885BCR 298/4885
US-20070191376-A1 Bicyclic heteroaryl compounds CYP3A43, CYP11B2, CYP2F1 ABL1 110/4885ABL2 1006/4885BCR 250/4885

“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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