SCHEMBL25567822

SCHEMBL25567822

Clc1ccc2c(c1)oc1c(-c3ccccc3-c3ccccc3)cccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 4/20 0.54
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ ALOX5 P09917 2/20 0.44
▸ PRKDC P78527 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ADORA3 P0DMS8 2/20 0.38
▸ TNKS O95271 1/20 0.38
▸ CDC25A P30304 1/20 0.38
▸ CDC25C P30307 1/20 0.38
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB1 P18505 1/20 0.38
▸ GABRG2 P18507 1/20 0.38
▸ GABRB3 P28472 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ GABRA3 P34903 1/20 0.38
▸ GABRA2 P47869 1/20 0.38

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
SCHEMBL30203651 0.94 AHR (0.57) AHRCA1CA2ALOX5PRKDC
SCHEMBL22763942 0.94 AHR (0.57) AHRCA1CA2ALOX5PRKDC
SCHEMBL25073586 0.91 AHR (0.54) AHRCA1CA2ALOX5PRKDC
SCHEMBL22738104 0.88 AHR (0.71) AHRALOX5PRKDCKDM4EKMT2A
SCHEMBL23313430 0.87 ALOX5 (0.54) AHRALOX5PRKDCKDM4EKMT2A
SCHEMBL23313986 0.87 ALOX5 (0.54) AHRCA1CA2ALOX5PRKDC
SCHEMBL20754224 0.86 AHR (0.49) AHRCA1CA2ALOX5KDM4E
SCHEMBL26678045 0.84 ALOX5 (0.49) AHRCA1CA2ALOX5PRKDC
SCHEMBL31336586 0.84 ALOX5 (0.49) AHRCA1CA2ALOX5PRKDC
SCHEMBL21191942 0.84 AHR (0.54) AHRCA1CA2ALOX5KDM4E

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-2023096209-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-06-01 — — WO disclosed
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