SCHEMBL27384048

SCHEMBL27384048

c1ccc(-c2ccc(-c3ccc(Nc4ccccc4-c4ccc5sc6ccccc6c5c4)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP3K8 P41279 3/20 0.41
▸ PTGIR P43119 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ GPR3 P46089 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ PIM3 Q86V86 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ IDO1 P14902 1/20 0.37
▸ CDC25B P30305 2/20 0.36
▸ RIPK2 O43353 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ TGFBR1 P36897 1/20 0.36
▸ ALK Q9UM73 1/20 0.36

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
SCHEMBL18333651 0.99 MAP3K8 (0.40) MAP3K8PTGIRMAPTGPR3ALOX5
SCHEMBL18294162 0.96 PIM3 (0.40) MAP3K8PTGIRMAPTGPR3ALOX5
SCHEMBL25502796 0.95 PTGIR (0.39) MAP3K8PTGIRMAPTGPR3ALOX5
SCHEMBL23168466 0.94 MAPT (0.43) MAP3K8PTGIRMAPTGPR3ALOX5
SCHEMBL30659240 0.91 IDO1 (0.46) MAP3K8PTGIRMAPTGPR3ALOX5
SCHEMBL20317139 0.91 PIM3 (0.39) MAP3K8PTGIRMAPTGPR3ALOX5
SCHEMBL27384031 0.90 PTGIR (0.39) MAP3K8PTGIRMAPTGPR3ALOX5
SCHEMBL17968618 0.90 FABP3 (0.43) PTGIRMAPTGPR3ALOX5PIM3
SCHEMBL27384050 0.89 ALK (0.43) MAP3K8MAPTPIM3KDM4EMEN1
SCHEMBL18216689 0.89 PTGIR (0.48) MAP3K8PTGIRMAPTGPR3ALOX5

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-2024080655-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE HAVING SAME 덕산네오룩스 주식회사 2024-04-18 — — WO disclosed
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