SCHEMBL24778558

SCHEMBL24778558

Cc1cc2c(c(C)c1Nc1csc3ccc(C(C)(C)C)cc13)OCCO2

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ TRPV1 Q8NER1 7/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ADRA2A P08913 2/20 0.31
▸ ADRA2C P18825 2/20 0.31
▸ ADRA1D P25100 2/20 0.31
▸ ADRA1A P35348 2/20 0.31
▸ ADRA1B P35368 2/20 0.31
▸ ADRA2B P18089 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
SCHEMBL24779292 0.81 KDM4E (0.41) KDM4ETSHRRAB9A
SCHEMBL24778835 0.80 TRPV1 (0.40) TRPV1MEN1MAPTTSHRMAPK1
SCHEMBL24779265 0.79 TRPV1 (0.33) TRPV1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL24778599 0.73 KDM4E (0.31) KDM4E
SCHEMBL23444395 0.71 KDM4E (0.44) KDM4ETRPV1MEN1MAPTRAB9A
SCHEMBL29292676 0.68 KDM4E (0.41) KDM4EMEN1MAPTKMT2A
SCHEMBL24897277 0.67 KDM4E (0.48) KDM4ETRPV1MAPTTSHRMAPK1
SCHEMBL25952526 0.67 L3MBTL1 (0.41) KDM4EMAPTTSHRKMT2ASMN1; SMN2
SCHEMBL25037436 0.67 CYP2A6 (0.56) KDM4ETRPV1MEN1MAPTTSHR
SCHEMBL24636684 0.66 HTR1D (0.40) TRPV1MEN1RAB9AKMT2ASMN1; SMN2

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-2022255634-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-12-08 — — WO disclosed
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