SCHEMBL24156119

SCHEMBL24156119

c1ccc(-c2nc3ccccc3s2)c(Nc2ccc3sc4ccccc4c3c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ PTGIR P43119 1/20 0.46
▸ TP53 P04637 3/20 0.45
▸ USP2 O75604 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ EGFR P00533 5/20 0.44

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 1.00 MAPT (0.47) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24156115 0.91 MAPT (0.49) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24155734 0.83 FLT4 (0.60) MAPTKDM4ERAB9ANPC1MEN1
SCHEMBL24156101 0.83 MAPT (0.48) MAPTKDM4ERAB9ANPC1MEN1
SCHEMBL24155566 0.82 MAPT (0.57) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24156120 0.82 KDR (0.50) MAPTKDM4ERAB9ANPC1NPSR1
SCHEMBL24156118 0.81 RAB9A (0.56) MAPTKDM4ERAB9ANPC1MEN1
SCHEMBL24155747 0.80 AURKA (0.47) MAPTKDM4ERAB9ANPC1MEN1
SCHEMBL18216689 0.80 PTGIR (0.48) MAPTKDM4ERAB9ANPC1MEN1
SCHEMBL29514897 0.80 PTGIR (0.48) MAPTKDM4ERAB9ANPC1MEN1

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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