SCHEMBL31362933

SCHEMBL31362933

Cc1cc(C)c2c(c1)oc1cc(Cl)ccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 6/20 0.56
▸ ESR1 P03372 1/20 0.44
▸ ESR2 Q92731 1/20 0.44
▸ MCL1 Q07820 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ PON1 P27169 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TTR P02766 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ RAPGEF4 Q8WZA2 2/20 0.38
▸ CA12 O43570 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ CDC25A P30304 1/20 0.36
▸ CDC25C P30307 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CA1 P00915 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
SCHEMBL26293017 0.85 ESR1 (0.49) AHRESR1ESR2KDM4EPON1
SCHEMBL2966509 0.81 AHR (0.59) AHRMCL1KDM4ERAB9ATTR
SCHEMBL25720298 0.80 AHR (0.62) AHRMCL1KDM4EKMT2ATTR
SCHEMBL25976359 0.77 AHR (0.45) AHRESR1ESR2MCL1TTR
SCHEMBL17920843 0.77 MAOA (0.44) AHRESR1ESR2KDM4EPON1
SCHEMBL29706029 0.75 AHR (0.63) AHRMCL1TTRCDC25ACDC25C
SCHEMBL20208693 0.75 AHR (0.63) AHRMCL1TTRCDC25ACDC25C
SCHEMBL22737968 0.74 AHR (0.78) AHRMCL1KDM4ETTRCDC25A
SCHEMBL23312499 0.74 AHR (0.55) AHRKDM4ERAB9AKMT2AMAPT
SCHEMBL8961941 0.74 TTR (0.59) AHRMCL1ADORA3KMT2ATTR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250017034-A1 LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, AND AMINE COMPOUND FOR THE LIGHT-EMITTING ELEMENT SAMSUNG DISPLAY CO., LTD. (KR) 2025-01-09 — — US disclosed
CN-119176756-A Light-emitting element, display device, and amine compound for light-emitting element 三星显示有限公司 2024-12-24 — — CN disclosed
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