SCHEMBL9837609

SCHEMBL9837609

C=CCn1c(=O)sc2cc(F)c(N=C=S)cc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SHMT2 P34897 1/20 0.40
GAA P10253 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
CYP3A4 P08684 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
SCHEMBL9838712 0.89 SHMT2 (0.41) SHMT2GAAKDM4EALDH1A1MAPT
SCHEMBL30945117 0.89 SHMT2 (0.41) SHMT2GAAKDM4EALDH1A1MAPT
SCHEMBL9781834 0.82 POLB (0.33)
SCHEMBL8931497 0.77 CNR2 (0.35)
SCHEMBL8355924 0.76 SHMT2 (0.45) SHMT2GAAKDM4EALDH1A1MAPT
SCHEMBL9686339 0.74 GRIN1 (0.40)
SCHEMBL9837669 0.73 MAPT (0.40) GAAALDH1A1MAPT
SCHEMBL9837540 0.73 SHMT2 (0.42) SHMT2GAAKDM4EALDH1A1MAPT
SCHEMBL9478143 0.71 POLB (0.34)
SCHEMBL9839357 0.68 SHMT2 (0.39) SHMT2GAAKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230874-B1 BENZOTHIAZOLYLAZOLIDINES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-11-27 EP disclosed
US-4898948-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-02-06 US disclosed
US-4828605-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-05-09 US disclosed
US-4786310-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-22 US disclosed
EP-0230874-A1 Benzothiazolylazolidines, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-08-05 EP disclosed