SCHEMBL1077442

SCHEMBL1077442

COC(=O)Nc1ncc2cc(-c3cc(C(=O)Nc4cccc(C(F)(F)F)c4)ccc3C)c(O)c(-c3ccnc(C)c3)c2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.52
MAPK14 Q16539 10/20 0.52
LCK P06239 7/20 0.52
JAK3 P52333 5/20 0.52
TEK Q02763 4/20 0.52
BRAF P15056 4/20 0.52
RAF1 P04049 3/20 0.48
DDR2 Q16832 4/20 0.47
KIT P10721 5/20 0.47
ABL1 P00519 2/20 0.47
BCR P11274 2/20 0.47
DDR1 Q08345 2/20 0.47
SYK P43405 2/20 0.46
YES1 P07947 1/20 0.45
SRC P12931 1/20 0.44
TYK2 P29597 1/20 0.44
MAPK8 P45983 1/20 0.44
MAPK9 P45984 1/20 0.44
MAPK10 P53779 1/20 0.44
BTK Q06187 1/20 0.44

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
SCHEMBL1083477 0.93 KDR (0.55) KDRMAPK14LCKJAK3TEK
SCHEMBL1149222 0.92 KDR (0.62) KDRMAPK14LCKJAK3TEK
SCHEMBL1078499 0.90 ABL1 (0.52) KDRMAPK14LCKJAK3TEK
SCHEMBL1077822 0.90 MAPK14 (0.54) KDRMAPK14LCKJAK3TEK
SCHEMBL1079780 0.89 LCK (0.55) KDRMAPK14LCKJAK3TEK
SCHEMBL1077383 0.89 KDR (0.54) KDRMAPK14LCKJAK3TEK
SCHEMBL1079445 0.84 LCK (0.60) KDRMAPK14LCKJAK3TEK
SCHEMBL1079204 0.83 KDR (0.56) KDRMAPK14LCKJAK3TEK
SCHEMBL1078689 0.83 LCK (0.61) KDRMAPK14LCKJAK3TEK
SCHEMBL1079570 0.82 KDR (0.64) KDRMAPK14LCKJAK3TEK

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

“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.