SCHEMBL22059188

SCHEMBL22059188

BN(c1ccccc1)c1cccc2c1oc1ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.39
▸ AHR P35869 3/20 0.37
▸ MAOA P21397 3/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ MAPT P10636 5/20 0.33
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ HPGD P15428 4/20 0.33
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ CASP7 P55210 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ PGAM1 P18669 1/20 0.33
▸ CASP1 P29466 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
SCHEMBL25061152 0.90 ALOX5 (0.43) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL22053505 0.84 MEN1 (0.35) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL25061137 0.84 TNKS (0.40) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL15306316 0.83 ALOX5 (0.41) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL15178580 0.83 ALOX5 (0.41) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL14295291 0.81 ALOX5 (0.40) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL22059011 0.81 MCL1 (0.40) MAOAALDH1A1SMN1; SMN2MCL1
SCHEMBL20650381 0.80 ALOX5 (0.39) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL15747049 0.80 TOP2A (0.44) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL21763093 0.80 ALOX5 (0.42) ALOX5AHRMAOAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230059210-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2023-02-23 — — US disclosed
US-20230058635-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2023-02-23 — — US disclosed
WO-2020109269-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2020-06-04 — — WO disclosed
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