SCHEMBL24856398

SCHEMBL24856398

c1ccc(-c2cccc(N(c3ccccc3)c3ccc4c(c3)oc3ccccc34)c2-c2cccc3c2oc2ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.41
▸ GGPS1 O95749 1/20 0.36
▸ PRKDC P78527 7/20 0.36
▸ AHR P35869 2/20 0.34
▸ PTGES2 Q9H7Z7 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ DYRK1A Q13627 1/20 0.30
▸ PIK3CD O00329 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
SCHEMBL24840135 0.93 ALOX5 (0.44) ALOX5GGPS1PRKDCAHRPTGES2
SCHEMBL27018047 0.93 ALOX5 (0.42) ALOX5GGPS1PRKDCAHRPTGES2
SCHEMBL27017901 0.93 ALOX5 (0.41) ALOX5GGPS1PRKDCAHRPTGES2
SCHEMBL25577400 0.92 ALOX5 (0.44) ALOX5GGPS1PRKDCAHRPTGES2
SCHEMBL24856488 0.92 AHR (0.36) ALOX5PRKDCAHRMEN1KMT2A
SCHEMBL24856491 0.91 MEN1 (0.37) ALOX5AHRMEN1KMT2AMAPT
SCHEMBL27017860 0.90 ALOX5 (0.43) ALOX5GGPS1PRKDCPTGES2PRMT5
SCHEMBL24856395 0.90 AHR (0.35) ALOX5AHRMEN1KMT2AMAPT
SCHEMBL25577287 0.89 ALOX5 (0.40) ALOX5GGPS1PRKDCAHRPTGES2
SCHEMBL27017959 0.89 ALOX5 (0.43) ALOX5GGPS1PRKDCPTGES2PRMT5

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-2023273997-A1 ORGANIC COMPOUND AND APPLICATION THEREOF 北京鼎材科技有限公司 2023-01-05 — — WO disclosed
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