SCHEMBL23923248

SCHEMBL23923248

COc1ccc(N(c2cccc(-c3ccc(F)cc3F)n2)c2cccc(-c3ccc(F)cc3F)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.40
▸ AMY1A P0DUB6 1/20 0.40
▸ CHRNA7 P36544 2/20 0.39
▸ F2RL3 Q96RI0 1/20 0.39
▸ PTGDR2 Q9Y5Y4 2/20 0.39
▸ HSD17B14 Q9BPX1 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ NFE2L2 Q16236 1/20 0.36
▸ ALPL P05186 1/20 0.36
▸ AR P10275 1/20 0.35
▸ KMO O15229 1/20 0.35
▸ SQOR Q9Y6N5 1/20 0.35
▸ AGER Q15109 2/20 0.35
▸ SYK P43405 1/20 0.35

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
SCHEMBL5117466 0.84 KMO (0.43) SCN9AHSD17B14NPC1RAB9AKMO
SCHEMBL13261826 0.72 KMO (0.51) SCN9AF2RL3NPC1RAB9AALPL
SCHEMBL23923249 0.69 CLK1 (0.43) PTGDR2SMN1; SMN2
SCHEMBL15888380 0.69 CCR1 (0.52) SCN9AF2RL3ARKMOAGER
SCHEMBL19072692 0.68 KMO (0.47) SCN9AF2RL3NPC1RAB9AALPL
SCHEMBL6068558 0.68 CYP2C19 (0.55) AMY1ANPC1RAB9ASMN1; SMN2NFE2L2
SCHEMBL22443378 0.68 NPC1 (0.48) AMY1ACHRNA7F2RL3NPC1RAB9A
SCHEMBL29463693 0.68 NPC1 (0.48) AMY1ACHRNA7F2RL3NPC1RAB9A
SCHEMBL18390809 0.67 NFE2L2 (0.57) NPC1RAB9ANFE2L2
SCHEMBL23943351 0.66 HSD17B14 (0.61) HSD17B14

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
EP-3896138-A1 USE OF D8 METAL COMPLEX COMPOUNDS WITH LIGAND-CONTROLLED AGGREGATION AND LUMINESCENCE PROPERTIES Bundesanstalt für Materialforschung und -Prüfung (BAM) (DE) 2021-10-20 — — EP disclosed
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