SCHEMBL24156115

SCHEMBL24156115

c1ccc2sc(-c3ccc(Nc4ccc5sc6ccccc6c5c4)c4ccccc34)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.49
▸ KDM4E B2RXH2 5/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ EGFR P00533 7/20 0.46
▸ KDR P35968 5/20 0.46
▸ IGF1R P08069 4/20 0.46
▸ SRC P12931 3/20 0.46
▸ EPHB4 P54760 2/20 0.46
▸ TEK Q02763 5/20 0.46
▸ AURKB Q96GD4 2/20 0.46
▸ AURKA O14965 2/20 0.46
▸ INSR P06213 1/20 0.46
▸ FLT4 P35916 3/20 0.45
▸ PTGIR P43119 1/20 0.45
▸ ERBB2 P04626 1/20 0.43
▸ MEN1 O00255 5/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ GAA P10253 4/20 0.43

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
SCHEMBL30954652 0.91 MAPT (0.47) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24156119 0.91 MAPT (0.47) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24156120 0.91 KDR (0.50) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24156079 0.86 MAPT (0.47) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24155559 0.82 RAB9A (0.56) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24155734 0.82 FLT4 (0.60) MAPTKDM4ERAB9ANPC1EGFR
SCHEMBL24374448 0.81 PTGIR (0.45) MAPTKDM4ERAB9ANPC1PTGIR
SCHEMBL24156118 0.80 RAB9A (0.56) MAPTKDM4ERAB9ANPC1EGFR
SCHEMBL30883933 0.76 APP (0.57) MAPTKDM4ERAB9ANPC1EGFR
SCHEMBL26103923 0.76 APP (0.57) MAPTKDM4ERAB9ANPC1EGFR

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-2021261851-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT 덕산네오룩스 주식회사 2021-12-30 — — WO disclosed
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