SCHEMBL9611038

SCHEMBL9611038

Cc1ccc(C(=O)Nc2cc(-n3ccnc3)cc(C(F)(F)F)c2)cc1-c1cnc2ccccn12

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 15/20 0.74
DDR1 Q08345 8/20 0.58
BCR P11274 6/20 0.56
DDR2 Q16832 6/20 0.56
KIT P10721 4/20 0.56

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
SCHEMBL9610957 0.92 DDR1 (0.65) ABL1DDR1BCRDDR2KIT
SCHEMBL9610923 0.89 NR2E1 (0.64) ABL1DDR1BCRDDR2KIT
SCHEMBL10266411 0.88 ABL1 (0.74) ABL1BCR
SCHEMBL9611040 0.86 ABL1 (0.75) ABL1DDR1BCRDDR2KIT
SCHEMBL9611146 0.86 ABL1 (0.57) ABL1DDR1BCRDDR2KIT
SCHEMBL9610998 0.85 DDR1 (0.56) ABL1DDR1BCRDDR2KIT
SCHEMBL588662 0.85 ABL1 (1.00) ABL1DDR1DDR2
SCHEMBL28778717 0.84 ABL1 (0.69) ABL1BCRKIT
SCHEMBL9610798 0.83 ABL1 (0.59) ABL1DDR1BCRDDR2KIT
SCHEMBL13813436 0.83 ABL1 (0.55) ABL1DDR1BCRDDR2KIT

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-2013162727-A1 METHODS AND COMPOSITIONS FOR RAF KINASE MEDIATED DISEASES ARIAD PHARMACEUTICALS, INC. (US) 2013-10-31 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 110/4885DDR1 4853/4885BCR 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.