SCHEMBL230101

SCHEMBL230101

Cc1cccc(C)c1-c1ccc2nc(Nc3ccc(N4CCN(C(=O)c5ccncc5)CC4)cc3)ncc2c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.50
SRC P12931 3/20 0.49
EPHB4 P54760 1/20 0.49
MAPK10 P53779 1/20 0.46
RAF1 P04049 1/20 0.46
MAP4K1 Q92918 1/20 0.46
ALK Q9UM73 1/20 0.46
SYK P43405 1/20 0.46
MAPT P10636 1/20 0.45
HTT P42858 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
SCHEMBL229526 0.89 ALK (0.59) ALKSYK
SCHEMBL5501445 0.84 MAP4K1 (0.64) SRCMAP4K1ALK
SCHEMBL226380 0.81 STK17A (0.58) MAP4K1
SCHEMBL3042059 0.77 BRAF (0.62) BRAFSRCRAF1
SCHEMBL229295 0.76 SRC (0.60) BRAFSRCALK
SCHEMBL2573807 0.75 SRC (0.53) BRAFSRC
SCHEMBL2573809 0.75 YES1 (0.53) BRAFSRCEPHB4
SCHEMBL3041756 0.73 MYLK4 (0.62) BRAFMAPK10MAP4K1SYK
SCHEMBL4892563 0.72 CCND3 (0.56) MAPK10MAP4K1SYKMAPT
SCHEMBL4375062 0.71 JAK2 (0.75)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389530-B2 Substituted quinazoline compounds FOVEA PHARMACEUTICALS (FR) 2013-03-05 US claimed
US-20120004210-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS FOVEA PHARMACEUTICALS SA 2012-01-05 US claimed
US-8389530-B2 Substituted quinazoline compounds FOVEA PHARMACEUTICALS (FR) 2013-03-05 US disclosed
US-20120004210-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS FOVEA PHARMACEUTICALS SA 2012-01-05 US 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-20120004210-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS MAP3K5, MAP3K1, MAP3K2 BRAF 50/4885SRC 1325/4885EPHB4 1999/4885

“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.