SCHEMBL1319122

SCHEMBL1319122

CC(C)(C)n1nc(Cc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)c2c(N)ncnc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 9/20 0.61
▸ AKT1 P31749 1/20 0.59
▸ KDR P35968 6/20 0.57
▸ FLT1 P17948 4/20 0.49
▸ KIT P10721 3/20 0.49
▸ TEK Q02763 3/20 0.49
▸ AURKA O14965 2/20 0.49
▸ AURKB Q96GD4 2/20 0.49
▸ LCK P06239 2/20 0.49
▸ LYN P07948 2/20 0.49
▸ FLT4 P35916 2/20 0.49
▸ FLT3 P36888 2/20 0.49
▸ BLK P51451 2/20 0.49
▸ ABL1 P00519 2/20 0.49
▸ FYN P06241 2/20 0.49
▸ CDK19 Q9BWU1 1/20 0.49
▸ CSF1R P07333 1/20 0.49
▸ RIPK1 Q13546 3/20 0.49
▸ RET P07949 2/20 0.49
▸ DCLK1 O15075 1/20 0.49

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
SCHEMBL12123450 0.91 SRC (0.59) SRCAKT1KDRAURKABLK
SCHEMBL1321244 0.90 KDR (0.59) SRCKDRFLT1KITTEK
SCHEMBL12120701 0.89 SRC (0.64) SRCAKT1KDRKITTEK
SCHEMBL1320636 0.87 SRC (0.70) SRCKDRFLT1KITTEK
SCHEMBL24353316 0.87 SRC (0.73) SRCAKT1ABL1FYNRIPK1
SCHEMBL1320583 0.85 KDR (0.56) SRCKDRFLT1KITTEK
SCHEMBL12120455 0.83 KDR (0.67) SRCKDRFLT1KITTEK
SCHEMBL12120492 0.83 KDR (0.54) SRCKDRFLT1KITTEK
SCHEMBL1318792 0.83 SRC (0.62) SRCKDRFLT1KITTEK
SCHEMBL13063868 0.82 SRC (0.74) SRCAKT1ABL1FYNCSNK1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2358720-B1 FUSED RING HETEROARYL KINASE INHIBITORS UNIV CALIFORNIA (US) 2016-03-02 — — EP disclosed
US-8697709-B2 Fused ring heteroaryl kinase inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-04-15 — — US disclosed
US-20110275651-A1 FUSED RING HETEROARYL KINASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-11-10 — — US disclosed
US-20110275651-A1 FUSED RING HETEROARYL KINASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-11-10 — — US disclosed
US-20110275651-A1 FUSED RING HETEROARYL KINASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-11-10 — — US disclosed
EP-2358720-A2 FUSED RING HETEROARYL KINASE INHIBITORS The Regents of the University of California (US) 2011-08-24 — — EP disclosed
WO-2010045542-A2 FUSED RING HETEROARYL KINASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-04-22 — — WO 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-20110275651-A1 FUSED RING HETEROARYL KINASE INHIBITORS CNKSR1, MAP3K20, TTK SRC 180/4885AKT1 57/4885KDR 837/4885

“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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