SCHEMBL30050234

SCHEMBL30050234

CNC(=O)c1cc(OC)cc(Oc2ccnc3ccc(C(F)(F)F)cc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDR2 Q16832 1/20 0.53
▸ MET P08581 3/20 0.49
▸ AXL P30530 1/20 0.49
▸ MERTK Q12866 1/20 0.49
▸ KDR P35968 8/20 0.48
▸ MAPK14 Q16539 2/20 0.46
▸ BRAF P15056 1/20 0.46
▸ TNNI3K Q59H18 1/20 0.46
▸ GAK O14976 3/20 0.46
▸ RIPK2 O43353 2/20 0.46
▸ NLK Q9UBE8 2/20 0.46
▸ STK16 O75716 1/20 0.46
▸ EGFR P00533 1/20 0.46
▸ AAK1 Q2M2I8 1/20 0.46
▸ BMP2K Q9NSY1 1/20 0.46
▸ IRAK3 Q9Y616 1/20 0.46
▸ FGFR2 P21802 1/20 0.45
▸ AURKA O14965 2/20 0.45
▸ TEK Q02763 2/20 0.45
▸ AURKB Q96GD4 2/20 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
SCHEMBL29186551 1.00 DDR2 (0.53) DDR2METAXLMERTKKDR
SCHEMBL30051204 0.84 DDR2 (0.56) DDR2METAXLMERTKKDR
SCHEMBL29186585 0.84 DDR2 (0.56) DDR2METAXLMERTKKDR
SCHEMBL29186556 0.84 DDR2 (0.77) DDR2METAXLMERTKKDR
SCHEMBL30050085 0.83 KDR (0.46) DDR2METAXLMERTKKDR
SCHEMBL29186558 0.83 KDR (0.46) DDR2METAXLMERTKKDR
SCHEMBL29318681 0.83 DDR2 (0.54) DDR2METAXLMERTKKDR
SCHEMBL30049303 0.83 DDR2 (0.54) DDR2METAXLMERTKKDR
SCHEMBL30702362 0.81 DDR2 (0.50) DDR2METKDRMAPK14BRAF
SCHEMBL29186554 0.81 DDR2 (0.50) DDR2METKDRMAPK14BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4330233-A1 PHENYL -O-QUINOLINE, QUINAZOLINE, THIENOPYRIDINE, THIENOPYRIMIDINE, PYRROLOPYRIDINE, PYRROLOPYRIMIDINE COMPOUNDS HAVING ANTICANCER ACTIVITY Chengdu Anticancer Bioscience, Ltd. (CN) 2024-03-06 — — EP disclosed
WO-2022228549-A1 PHENYL -O-QUINOLINE, QUINAZOLINE, THIENOPYRIDINE, THIENOPYRIMIDINE, PYRROLOPYRIDINE, PYRROLOPYRIMIDINE COMPOUNDS HAVING ANTICANCER ACTIVITY Chengdu Anticancer Bioscience, Ltd. (CN) 2022-11-03 — — WO disclosed
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