SCHEMBL30050488

SCHEMBL30050488

COc1cc(NC(C)=O)cc(Oc2ccnc3ccc(OC)cc23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 1/20 1.00
MET P08581 2/20 0.55
PDGFRA P16234 9/20 0.55
KDR P35968 9/20 0.55
KDM4E B2RXH2 2/20 0.51
MAPK1 P28482 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
LMNA P02545 1/20 0.50
CSF1R P07333 2/20 0.49
PDGFRB P09619 2/20 0.49
FGFR2 P21802 1/20 0.48

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
SCHEMBL29317847 1.00 DDR2 (1.00) DDR2METPDGFRAKDRKDM4E
SCHEMBL29318211 0.91 DDR2 (0.83) DDR2METPDGFRAKDRCSF1R
SCHEMBL29317854 0.91 DDR2 (0.83) DDR2METPDGFRAKDRCSF1R
SCHEMBL30050292 0.91 DDR2 (0.83) DDR2METPDGFRAKDRCSF1R
SCHEMBL29317860 0.90 DDR2 (0.82) DDR2METPDGFRAKDRFGFR2
SCHEMBL30051291 0.90 DDR2 (0.82) DDR2METPDGFRAKDRCSF1R
SCHEMBL30049816 0.90 DDR2 (0.82) DDR2METPDGFRAKDRFGFR2
SCHEMBL29186568 0.90 DDR2 (0.82) DDR2METPDGFRAKDRCSF1R
SCHEMBL29186589 0.90 DDR2 (0.82) DDR2METPDGFRAKDRFGFR2
SCHEMBL30050295 0.90 DDR2 (0.82) DDR2METPDGFRAKDRFGFR2

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