SCHEMBL1080552

SCHEMBL1080552

COc1c(-c2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)cc2cnc(N)nc2c1-c1cnc(N)nc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LCK P06239 13/20 0.64
KDR P35968 10/20 0.64
MAPK14 Q16539 7/20 0.64
TEK Q02763 6/20 0.64
JAK3 P52333 4/20 0.64
KIT P10721 3/20 0.57
DDR2 Q16832 1/20 0.53
BRAF P15056 3/20 0.53
CSF1R P07333 1/20 0.51
BTK Q06187 1/20 0.51
PDGFRB P09619 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
RAF1 P04049 1/20 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
SCHEMBL1077177 0.96 LCK (0.61) LCKKDRMAPK14TEKJAK3
SCHEMBL1077187 0.95 LCK (0.61) LCKKDRMAPK14TEKJAK3
SCHEMBL1083164 0.95 LCK (0.59) LCKKDRMAPK14TEKJAK3
SCHEMBL1149125 0.95 LCK (0.61) LCKKDRMAPK14TEKJAK3
SCHEMBL1149456 0.94 LCK (0.62) LCKKDRMAPK14TEKJAK3
SCHEMBL1148793 0.94 LCK (0.62) LCKKDRMAPK14TEKJAK3
SCHEMBL1149752 0.94 LCK (0.64) LCKKDRMAPK14TEKJAK3
SCHEMBL1077470 0.93 LCK (0.61) LCKKDRMAPK14TEKJAK3
SCHEMBL1078814 0.93 KDR (0.61) LCKKDRMAPK14TEKJAK3
SCHEMBL1149330 0.93 LCK (0.63) LCKKDRMAPK14TEKJAK3

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 LCK 3187/4885KDR 896/4885MAPK14 2338/4885

“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.