SCHEMBL24636468

SCHEMBL24636468

Cc1cc(N(c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)c(Cl)c(N(c2ccc3c(c2)OCCO3)c2ccc(C(C)(C)C)cc2-c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 7/20 0.34
▸ CYP19A1 P11511 1/20 0.32
▸ PTPN1 P18031 1/20 0.31
▸ PDCD1 Q15116 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ MTOR P42345 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL26625154 0.88 NPC1 (0.33) TSHRRAB9A
SCHEMBL24636359 0.87 TRPV1 (0.37) TRPV1MEN1MAPTTSHRMAPK1
SCHEMBL26722577 0.86 — —
SCHEMBL23432185 0.86 TSHR (0.35) MEN1MAPTTSHRRAB9AKMT2A
SCHEMBL24778221 0.85 — —
SCHEMBL26625366 0.85 CNR1 (0.32) —
SCHEMBL24779289 0.84 — —
SCHEMBL24779291 0.84 TRPV1 (0.32) TRPV1
SCHEMBL22432138 0.84 CNR1 (0.37) RAB9A
SCHEMBL24777992 0.84 — —

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-2022191560-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-09-15 — — WO disclosed
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