SCHEMBL13681340

SCHEMBL13681340

Cc1ccc(-c2cnc(CN)s2)o1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 17/20 0.44
▸ ALDH1A1 P00352 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ LOXL3 P58215 1/20 0.39
▸ LOX P28300 2/20 0.36
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ PBRM1 Q86U86 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 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
SCHEMBL13680728 0.78 ALDH1A1 (0.53) ALDH1A1POLBMAPTTHRBHTT
SCHEMBL13680727 0.73 LMNA (0.42) ALDH1A1POLBMAPTTHRBHTT
SCHEMBL13680724 0.72 DYRK1A (0.43) ALDH1A1POLBMAPTTHRBHTT
SCHEMBL13680729 0.72 APAF1 (0.34) ALDH1A1POLBMAPTTHRBHTT
SCHEMBL14854115 0.68 TDP1 (0.48) ALDH1A1POLBMAPTTHRBHTT
SCHEMBL14750526 0.67 TDP1 (0.42) ALDH1A1MAPTHSD17B10TDP1ADORA2A
SCHEMBL21812622 0.67 LOXL2 (0.84) LOXL2LOXL3MAOA
SCHEMBL13681329 0.67 LOXL2 (0.70) LOXL2ALDH1A1LOXL3LOXMAOA
SCHEMBL13681316 0.67 LOXL2 (0.50) LOXL2LOXL3LOXMAOAMAOB
SCHEMBL1366842 0.67 — —

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
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 — — US disclosed
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