SCHEMBL229386

SCHEMBL229386

CN(C)[C@@H]1CCN(C(=O)COc2ccc(Nc3ncc4cc(-c5cc(O)ccc5Cl)ccc4n3)cc2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 6/20 0.43
SRC P12931 4/20 0.40
ABL1 P00519 2/20 0.40
YES1 P07947 2/20 0.40
PDGFRB P09619 2/20 0.40
RIPK2 O43353 2/20 0.40
CIT O14578 1/20 0.40
GAK O14976 1/20 0.40
EPHB6 O15197 1/20 0.40
PRKD3 O94806 1/20 0.40
LCK P06239 1/20 0.40
RET P07949 1/20 0.40
BCR P11274 1/20 0.40
EPHA2 P29317 1/20 0.40
EPHB2 P29323 1/20 0.40
TYK2 P29597 1/20 0.40
KDR P35968 1/20 0.40
ACVR1B P36896 1/20 0.40
TGFBR1 P36897 1/20 0.40
ABL2 P42684 1/20 0.40

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
SCHEMBL229387 1.00 BRAF (0.43) BRAFSRCABL1YES1PDGFRB
SCHEMBL230632 0.89 SRC (0.49) BRAFSRCABL1YES1PDGFRB
SCHEMBL230633 0.89 SRC (0.49) BRAFSRCABL1YES1PDGFRB
SCHEMBL230426 0.85 SRC (0.45) BRAFSRCEGFRJAK3BTK
SCHEMBL230427 0.85 SRC (0.45) BRAFSRCEGFRJAK3BTK
SCHEMBL2576460 0.85 BRAF (0.41) BRAFSRCABL1YES1PDGFRB
SCHEMBL612998 0.84 TTK (0.39) BRAFSRCABL1YES1PDGFRB
SCHEMBL612999 0.84 TTK (0.39) BRAFSRCABL1YES1PDGFRB
SCHEMBL231015 0.82 BRAF (0.39) BRAFSRCABL1YES1PDGFRB
SCHEMBL229860 0.75 BRAF (0.68) BRAFSRCABL1YES1PDGFRB

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 1325/4885ABL1 442/4885

“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.