SCHEMBL9699790

SCHEMBL9699790

Cc1cn(-c2cc(C)c3c(c2)CSC(=S)N3)c(C)n1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL9700769 0.85
SCHEMBL9701071 0.80 HSD11B1 (0.34) ALDH1A1MAPTHPGDHSD17B10
SCHEMBL9700823 0.79 NR2E1 (0.36) ALDH1A1MAPTHPGDHSD17B10
SCHEMBL9700774 0.72 ALDH1A1 (0.32) ALDH1A1
SCHEMBL9700738 0.68 HSD11B1 (0.34) MAPT
SCHEMBL20929256 0.65 PNMT (0.35) MAPT
SCHEMBL9700770 0.63 NR2E1 (0.36)
SCHEMBL7321973 0.62 CYP11B1 (0.42)
SCHEMBL10680277 0.62 PDE3B (0.41)
SCHEMBL9700879 0.61 PSEN1 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5171851-A Cardiac stimulant DONG-A PHARM. CO., LTD. (KR) 1992-12-15 US claimed
EP-0510235-A1 Novel benzoxazine or benzothiazine derivatives and process for the preparation of the same DONG-A PHARM. CO., LTD. (KR) 1992-10-28 EP claimed
US-5171851-A Cardiac stimulant DONG-A PHARM. CO., LTD. (KR) 1992-12-15 US disclosed
EP-0510235-A1 Novel benzoxazine or benzothiazine derivatives and process for the preparation of the same DONG-A PHARM. CO., LTD. (KR) 1992-10-28 EP disclosed