SCHEMBL1078935

SCHEMBL1078935

Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)cc1-c1cc2cnc(N)nc2c(-c2cnc(N3CCOCC3)nc2)c1O

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRAF P15056 18/20 0.49
RAF1 P04049 10/20 0.47
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
SCHEMBL1078243 0.89 RAF1 (0.60) BRAFRAF1BTK
SCHEMBL1149471 0.87 RAF1 (0.61) BRAFRAF1
SCHEMBL1078927 0.86 LCK (0.48) BRAFBTK
SCHEMBL1080143 0.85 LCK (0.50) BRAFBTK
SCHEMBL1149288 0.85 LCK (0.48) BRAFBTK
SCHEMBL1083158 0.85 LCK (0.50) BRAFBTK
SCHEMBL1079343 0.85 LCK (0.45) BRAF
SCHEMBL1076926 0.85 LCK (0.48) BRAFBTK
SCHEMBL1079336 0.84 LCK (0.49) BRAFBTK
SCHEMBL1077552 0.84 LCK (0.49) BRAFBTK

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 781/4885BTK 1837/4885

“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.