SCHEMBL9427770

SCHEMBL9427770

CC([S])Sc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ LMNA P02545 2/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ SLC6A4 P31645 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ GAA P10253 2/20 0.36
▸ PKM P14618 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ PTPN1 P18031 1/20 0.33
▸ CDC25A P30304 1/20 0.33
▸ CDC25B P30305 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
SCHEMBL5173197 0.78 SMN1; SMN2 (0.45) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL1453001 0.78 SMN1; SMN2 (0.45) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL343269 0.78 SMN1; SMN2 (0.45) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL1713865 0.77 SMN1; SMN2 (0.50) MAOAMAOBSMN1; SMN2MAPTHPGD
Fluoride SCHEMBL1336886 0.76 MAOA (0.48) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL23331965 0.74 MAOA (0.52) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL7362590 0.74 MAOA (0.52) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL10399871 0.74 MAOA (0.41) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL1453376 0.74 MAOA (0.41) MAOAMAOBSMN1; SMN2MAPTHPGD
SCHEMBL3885342 0.74 MAOA (0.41) MAOAMAOBSMN1; SMN2MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5283341-A Catalytic alkylation NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1994-02-01 — — US disclosed
EP-0516982-A1 Process for producing a heterocyclic tertiary amine NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-12-09 — — EP disclosed
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