SCHEMBL9610992

SCHEMBL9610992

Cc1ccc(C(=O)Nc2ccc(CN3CC[C@@H](N(C)C)C3)c(C(F)(F)F)c2)cc1-c1cnc2cnccn12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 14/20 0.64
▸ BCR P11274 9/20 0.61
▸ DDR1 Q08345 6/20 0.61
▸ DDR2 Q16832 4/20 0.61
▸ LYN P07948 3/20 0.61
▸ MAPK14 Q16539 3/20 0.61
▸ CSK P41240 2/20 0.61
▸ ABL2 P42684 2/20 0.61
▸ BRAF P15056 2/20 0.61
▸ RIPK2 O43353 1/20 0.61
▸ LCK P06239 1/20 0.61
▸ FYN P06241 1/20 0.61
▸ RET P07949 1/20 0.61
▸ PDGFRB P09619 1/20 0.61
▸ ARAF P10398 1/20 0.61
▸ NQO2 P16083 1/20 0.61
▸ EPHA2 P29317 1/20 0.61
▸ EPHB2 P29323 1/20 0.61
▸ FRK P42685 1/20 0.61
▸ MAPKAPK2 P49137 1/20 0.61

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
SCHEMBL9610971 0.96 ABL1 (0.62) ABL1BCRDDR1DDR2LYN
SCHEMBL9610727 0.91 ABL1 (0.76) ABL1BCRDDR1DDR2LYN
SCHEMBL9611043 0.91 ABL1 (0.76) ABL1BCRDDR1DDR2LYN
SCHEMBL10265418 0.89 ABL1 (0.66) ABL1BCRDDR1DDR2MAPK14
SCHEMBL9611036 0.88 ABL1 (0.75) ABL1BCRDDR1MAPK14ABL2
SCHEMBL9611057 0.88 ABL1 (0.67) ABL1BCRDDR1DDR2LYN
SCHEMBL10268800 0.87 ABL1 (0.64) ABL1BCRDDR1DDR2MAPK14
SCHEMBL15871944 0.87 ABL1 (0.64) ABL1BCRDDR1DDR2MAPK14
SCHEMBL9611137 0.87 ABL1 (0.70) ABL1BCRABL2BRAFEGFR
SCHEMBL9610724 0.87 ABL1 (0.84) ABL1BCRDDR1DDR2LYN

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-20120135986-A1 Bicyclic Heteroaryl Compounds ARIAD PHARMACEUTICALS, INC. (US) 2012-05-31 — — 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-20120135986-A1 Bicyclic Heteroaryl Compounds CYP3A43, CYP11B2, CYP2F1 ABL1 110/4885BCR 250/4885DDR1 4853/4885

“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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