SCHEMBL9611040

SCHEMBL9611040

CC(=O)Nc1cccn2c(-c3cc(C(=O)Nc4cc(-n5ccnc5)cc(C(F)(F)F)c4)ccc3C)cnc12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 14/20 0.75
BCR P11274 6/20 0.53
DDR1 Q08345 5/20 0.50
BRAF P15056 2/20 0.48
SRC P12931 2/20 0.48
DDR2 Q16832 4/20 0.48
KIT P10721 4/20 0.48
EPHB2 P29323 2/20 0.46
LDLR P01130 2/20 0.45
PCSK9 Q8NBP7 2/20 0.45
EPHB6 O15197 1/20 0.45
CA12 O43570 1/20 0.45
CACNA1F O60840 1/20 0.45
SLC22A3 O75751 1/20 0.45
STK10 O94804 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
RAF1 P04049 1/20 0.45
LCK P06239 1/20 0.45
FYN P06241 1/20 0.45

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
SCHEMBL9610798 0.88 ABL1 (0.59) ABL1BCRDDR1BRAFSRC
SCHEMBL9611038 0.86 ABL1 (0.74) ABL1BCRDDR1DDR2KIT
SCHEMBL589960 0.86 ABL1 (1.00) ABL1BCRDDR1DDR2NTRK3
SCHEMBL9611006 0.85 ABL1 (0.56) ABL1BCRDDR1BRAFSRC
SCHEMBL9610957 0.85 DDR1 (0.65) ABL1BCRDDR1DDR2KIT
SCHEMBL10266411 0.81 ABL1 (0.74) ABL1BCR
SCHEMBL9610937 0.81 ABL1 (0.49) ABL1BCRDDR1BRAFSRC
SCHEMBL13813436 0.80 ABL1 (0.55) ABL1BCRDDR1BRAFSRC
SCHEMBL15061695 0.80 ABL1 (0.88) ABL1BCRDDR1DDR2NTRK3
SCHEMBL9610922 0.79 ABL1 (0.58) ABL1BCRDDR1BRAFSRC

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.