SCHEMBL1078797

SCHEMBL1078797

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-c1cc2cnc(NC3CCOCC3)nc2c(-c2ccc(F)nc2)c1O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.50
LCK P06239 5/20 0.50
MAPK14 Q16539 5/20 0.50
KDR P35968 4/20 0.50
JAK3 P52333 4/20 0.50
TEK Q02763 2/20 0.50
BTK Q06187 2/20 0.50
SRC P12931 1/20 0.50
TYK2 P29597 1/20 0.50
SYK P43405 1/20 0.50
MAPK8 P45983 1/20 0.50
MAPK9 P45984 1/20 0.50
MAPK10 P53779 1/20 0.50
RAF1 P04049 7/20 0.49
DDR2 Q16832 4/20 0.47
FGFR1 P11362 2/20 0.45
ABL1 P00519 1/20 0.45
TNK2 Q07912 1/20 0.45
MAP4K2 Q12851 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
SCHEMBL1077787 0.95 LCK (0.53) BRAFLCKMAPK14KDRJAK3
SCHEMBL1076887 0.94 BRAF (0.51) BRAFLCKMAPK14KDRJAK3
SCHEMBL1079615 0.92 LCK (0.49) BRAFLCKMAPK14KDRJAK3
SCHEMBL1078338 0.89 DDR2 (0.54) BRAFLCKMAPK14KDRJAK3
SCHEMBL1077557 0.88 RAF1 (0.52) BRAFLCKMAPK14KDRJAK3
SCHEMBL1149064 0.88 LCK (0.65) BRAFLCKMAPK14KDRJAK3
SCHEMBL1149045 0.87 KDR (0.56) BRAFLCKMAPK14KDRJAK3
SCHEMBL1077383 0.86 KDR (0.54) BRAFLCKMAPK14KDRJAK3
SCHEMBL1076762 0.86 LCK (0.54) BRAFLCKMAPK14KDRJAK3
SCHEMBL1078899 0.84 LCK (0.64) BRAFLCKMAPK14KDRJAK3

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 2498/4885LCK 3187/4885MAPK14 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.