SCHEMBL26045516

SCHEMBL26045516

c1ccc(N(c2ccc3c(c2)oc2ccccc23)c2cccc3c2ccc2c4ccccc4ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.39
▸ DUSP3 P51452 1/20 0.38
▸ MAPT P10636 4/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ HPGD P15428 4/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ HPRT1 P00492 3/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ GLA P06280 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ GAA P10253 2/20 0.35
▸ GPR55 Q9Y2T6 1/20 0.34
▸ HNF4A P41235 1/20 0.33
▸ TTR P02766 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL24472987 1.00 AHR (0.39) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL17637175 0.96 AHR (0.41) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL24372469 0.96 AHR (0.41) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL24472861 0.95 AHR (0.36) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL24472984 0.94 KDM4E (0.42) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL26851684 0.94 AHR (0.38) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL26851821 0.94 AHR (0.38) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL24372647 0.94 KDM4E (0.42) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL26854554 0.93 AHR (0.44) AHRDUSP3MAPTKDM4EHPGD
SCHEMBL26045752 0.93 CYP1A1 (0.37) AHRDUSP3MAPTKDM4EHPGD

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
WO-2024014934-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-01-18 — — WO disclosed
WO-2023153905-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-08-17 — — WO disclosed
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