SCHEMBL10789554

SCHEMBL10789554

COc1ccc(CSC(=O)Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.61
HTT P42858 2/20 0.49
LDHA P00338 1/20 0.49
F2RL1 P55085 1/20 0.47
EPHX1 P07099 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 1/20 0.46
CMA1 P23946 1/20 0.46
FFAR1 O14842 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
SAE1 Q9UBE0 1/20 0.45
UBA2 Q9UBT2 1/20 0.45

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
SCHEMBL10823756 0.84 IDO1 (0.59) IDO1HTTLDHAF2RL1EPHX1
SCHEMBL8488722 0.83 IDO1 (0.62) IDO1HTTLDHAF2RL1EPHX1
SCHEMBL5028690 0.83 IDO1 (0.62) IDO1HTTLDHAF2RL1EPHX1
SCHEMBL13905831 0.80 IDO1 (0.59) IDO1HTTLDHASMN1; SMN2ALDH1A1
SCHEMBL8436880 0.80 IDO1 (0.59) IDO1HTTLDHAF2RL1EPHX1
SCHEMBL8938869 0.79 IDO1 (0.57) IDO1HTTLDHAF2RL1EPHX1
SCHEMBL27629950 0.79 GAA (0.56) IDO1HTTLDHASMN1; SMN2ALDH1A1
SCHEMBL6571602 0.79 IDO1 (0.67) IDO1HTTSMN1; SMN2ALDH1A1CA1
SCHEMBL546685 0.77 IDO1 (0.60) IDO1HTTLDHAF2RL1EPHX1
SCHEMBL11438278 0.77 IDO1 (0.65) IDO1SMN1; SMN2ALDH1A1CA1CA2

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
US-4695314-A S-benzyl thiolcarbamates and their use in controlling weeds in rice fields STAUFFER CHEMICAL COMPANY (US) 1987-09-22 US disclosed
EP-0083648-B1 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS STAUFFER CHEMICAL COMPANY (US) 1986-06-04 EP disclosed
EP-0083648-A4 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS. STAUFFER CHEMICAL CO (US) 1984-01-10 EP disclosed
EP-0083648-A1 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS. STAUFFER CHEMICAL CO (US) 1983-07-20 EP disclosed
WO-1983000329-A1 S-BENZYL THIOLCARBAMATES AND THEIR USE IN CONTROLLING WEEDS IN RICE FIELDS STAUFFER CHEMICAL CO (US) 1983-02-03 WO disclosed