SCHEMBL1082660

SCHEMBL1082660

COc1c(-c2cc(C(=O)Nc3cc(CN4CCN(C)CC4)cc(C(F)(F)F)c3)ccc2C)cc2cnc(N)nc2c1Br

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 15/20 0.60
DDR1 Q08345 11/20 0.54
ABL1 P00519 8/20 0.54
KIT P10721 2/20 0.50
NTRK1 P04629 1/20 0.50
NTRK3 Q16288 1/20 0.50
NTRK2 Q16620 1/20 0.50
RET P07949 2/20 0.49
BRAF P15056 1/20 0.49
SRC P12931 1/20 0.48
BCR P11274 2/20 0.48

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
SCHEMBL1075954 0.95 BRAF (0.55) DDR2DDR1KITBRAF
SCHEMBL1079653 0.93 DDR2 (0.51) DDR2DDR1ABL1RETBRAF
SCHEMBL1149206 0.87 EGFR (0.63) ABL1KITRETBRAFSRC
SCHEMBL13219897 0.85 DDR2 (0.68) DDR2DDR1ABL1KITNTRK1
SCHEMBL1078646 0.82 LCK (0.51) BRAFSRC
SCHEMBL1078530 0.82 DDR2 (0.56) DDR2DDR1ABL1KITNTRK1
SCHEMBL13349275 0.82 DDR2 (0.73) DDR2DDR1ABL1KITNTRK1
SCHEMBL31620772 0.81 DDR2 (0.72) DDR2DDR1ABL1KITNTRK1
SCHEMBL5498924 0.81 DDR2 (0.72) DDR2DDR1ABL1KITNTRK1
SCHEMBL1078917 0.80 ABL1 (0.58) ABL1KITBRAFSRCBCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2269993-B1 2-AMINOQUINAZOLINE DERIVATIVE KYOWA HAKKO KIRIN CO LTD (JP) 2013-02-27 EP disclosed
US-20110039845-A1 2-AMINOQUINAZOLINE DERIVATIVE KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-02-17 US disclosed
EP-2269993-A1 2-AMINOQUINAZOLINE DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2011-01-05 EP 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-20110039845-A1 2-AMINOQUINAZOLINE DERIVATIVE H1-2, H1-3, H1-0 DDR2 2179/4885DDR1 4042/4885ABL1 47/4885

“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.