SCHEMBL24550534

SCHEMBL24550534

Clc1ccc2oc3cc4nc(Cl)sc4cc3c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 7/20 0.54
▸ LMNA P02545 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ GPR55 Q9Y2T6 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ TTR P02766 2/20 0.38
▸ TNKS O95271 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ LOXL2 Q9Y4K0 1/20 0.37
▸ PSMB8 P28062 1/20 0.37
▸ IDO1 P14902 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37

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
SCHEMBL24551558 0.94 AHR (0.54) AHRLMNAKMT2AALDH1A1GPR55
SCHEMBL24551969 0.90 AHR (0.50) AHRLMNAKMT2AALDH1A1MAPT
SCHEMBL24553410 0.84 AHR (0.50) AHRLMNAKMT2AALDH1A1MAPT
SCHEMBL24550447 0.83 SMN1; SMN2 (0.45) AHRLMNAKMT2AALDH1A1MAPT
SCHEMBL24552134 0.79 APP (0.43) AHRMAPTTHRBSMN1; SMN2HTT
SCHEMBL24550599 0.77 AHR (0.40) AHRKMT2AALDH1A1MAPTTTR
SCHEMBL24268388 0.76 AHR (0.79) AHRLMNAKMT2AALDH1A1GPR55
SCHEMBL2282515 0.76 AHR (0.78) AHRLMNAKMT2AALDH1A1GPR55
SCHEMBL24545379 0.76 AHR (0.49) AHRLMNAKMT2AALDH1A1GPR55
SCHEMBL24552283 0.76 AHR (0.44) AHRKMT2AALDH1A1MAPTTTR

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-2022131869-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-23 — — WO disclosed
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