SCHEMBL24229449

SCHEMBL24229449

C=Cc1ncc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc3)c3ccc(-c4cnc5ccccc5c4)cc3)cc2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 2/20 0.43
▸ PDGFRA P16234 2/20 0.43
▸ PIK3CA P42336 6/20 0.42
▸ PIK3CD O00329 5/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ BIRC5 O15392 1/20 0.40
▸ MAP4K4 O95819 1/20 0.39
▸ CSNK1G2 P78368 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ MAP4K5 Q9Y4K4 1/20 0.39
▸ CYP2A6 P11509 1/20 0.39
▸ MTOR P42345 5/20 0.38
▸ PIK3CB P42338 3/20 0.38
▸ PIK3CG P48736 3/20 0.38
▸ TDP2 O95551 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38

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
SCHEMBL23204767 0.84 PDGFRB (0.58) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL24229577 0.78 PDGFRB (0.66) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL24229569 0.78 PDGFRB (0.66) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL24229326 0.78 PIK3CD (0.43) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL26833448 0.77 PDGFRB (0.50) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL12112866 0.75 BIRC5 (0.55) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL26550770 0.74 PDGFRB (0.60) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL21613490 0.74 PSMB5 (0.46) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4
SCHEMBL29377935 0.73 NPC1 (0.61) PDGFRBPDGFRAPIK3CAPIK3CDCA12
SCHEMBL19467303 0.73 BIRC5 (0.66) PDGFRBPDGFRAPIK3CAPIK3CDCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022025648-A1 NOVEL COMPOUND FOR CAPPING LAYER AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 동진쎄미켐 2022-02-03 — — WO disclosed
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