SCHEMBL9610749

SCHEMBL9610749

Cc1ccc(C(=O)Nc2ccc(CN3CC[C@@H](N(C)C)C3)c(C(F)(F)F)c2)cc1-c1cnc2cccnn12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 16/20 0.64
▸ BCR P11274 5/20 0.61
▸ LYN P07948 4/20 0.59
▸ ABL2 P42684 3/20 0.59
▸ CSK P41240 3/20 0.59
▸ MAPK14 Q16539 3/20 0.59
▸ RIPK2 O43353 2/20 0.59
▸ LCK P06239 2/20 0.59
▸ FYN P06241 2/20 0.59
▸ RET P07949 2/20 0.59
▸ PDGFRB P09619 2/20 0.59
▸ BRAF P15056 2/20 0.59
▸ EPHA2 P29317 2/20 0.59
▸ EPHB2 P29323 2/20 0.59
▸ FRK P42685 2/20 0.59
▸ MAPKAPK2 P49137 2/20 0.59
▸ IRAK1 P51617 2/20 0.59
▸ EPHB3 P54753 2/20 0.59
▸ EPHA5 P54756 2/20 0.59
▸ EPHB4 P54760 2/20 0.59

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
SCHEMBL10266091 0.89 ABL1 (0.68) ABL1BCRLYNABL2CSK
SCHEMBL9611043 0.88 ABL1 (0.76) ABL1BCRLYNABL2CSK
SCHEMBL9610727 0.88 ABL1 (0.76) ABL1BCRLYNABL2CSK
SCHEMBL9610953 0.88 ABL1 (0.77) ABL1BCRLYNABL2CSK
SCHEMBL9610950 0.87 ABL1 (0.75) ABL1BCRLYNABL2CSK
SCHEMBL9610999 0.87 ABL1 (0.76) ABL1BCRLYNABL2CSK
SCHEMBL31734729 0.87 ABL1 (0.80) ABL1BCRLYNABL2CSK
SCHEMBL588873 0.87 ABL1 (0.80) ABL1BCRLYNABL2CSK
SCHEMBL12989932 0.87 ABL1 (0.80) ABL1BCRLYNABL2CSK
SCHEMBL588874 0.87 ABL1 (0.80) ABL1BCRLYNABL2CSK

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
WO-2012139027-A1 METHODS AND COMPOSITIONS FOR TREATING NEURODEGENERATIVE DISEASES ARIAD PHARMACEUTICALS, INC. (US) 2012-10-11 — — WO disclosed
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 250/4885LYN 2275/4885

“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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