SCHEMBL1079341

SCHEMBL1079341

COc1c(-c2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)cc2cnc(N)nc2c1-c1ccnc(N2CCNCC2)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.57
RAF1 P04049 13/20 0.57
KDR P35968 3/20 0.52
LCK P06239 2/20 0.52
JAK3 P52333 2/20 0.52
TEK Q02763 2/20 0.52
MAPK14 Q16539 2/20 0.52
PDGFRB P09619 1/20 0.47
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
NOD2 Q9HC29 1/20 0.46

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
SCHEMBL1078749 0.92 KDR (0.55) BRAFRAF1KDRLCKJAK3
SCHEMBL1079833 0.86 LCK (0.58) BRAFRAF1KDRLCKJAK3
SCHEMBL1078814 0.86 KDR (0.61) BRAFRAF1KDRLCKJAK3
SCHEMBL1082634 0.86 RAF1 (0.61) BRAFRAF1KDRLCKJAK3
SCHEMBL1080552 0.85 LCK (0.64) BRAFRAF1KDRLCKJAK3
SCHEMBL1078032 0.85 KDR (0.56) BRAFRAF1KDRLCKJAK3
SCHEMBL1078464 0.84 RAF1 (0.61) BRAFRAF1KDRLCKJAK3
SCHEMBL1149152 0.84 LCK (0.53) BRAFRAF1KDRLCKJAK3
SCHEMBL1079171 0.84 RAF1 (0.71) BRAFRAF1KDRLCKJAK3
SCHEMBL1149293 0.84 LCK (0.61) BRAFRAF1KDRLCKJAK3

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 BRAF 2498/4885RAF1 781/4885KDR 896/4885

“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.