SCHEMBL9843337

SCHEMBL9843337

C=C(COP(=O)(O)C=S)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.36
MAOA P21397 3/20 0.36
MAOB P27338 3/20 0.36
CYP2C9 P11712 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
ALOX15 P16050 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
CYP2C19 P33261 2/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TP53 P04637 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
PIN1 Q13526 1/20 0.32
AKT1 P31749 1/20 0.32

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
SCHEMBL9843340 0.73 MAOA (0.38) TSHRMAOAMAOBCYP2C9CYP1A2
SCHEMBL8722927 0.70 ALDH1A1 (0.39) MAOAMAOBCYP2C9CYP1A2ALDH1A1
SCHEMBL3752087 0.68 MAOA (0.50) MAOAMAOBCYP3A4ALOX15ALDH1A1
SCHEMBL9330920 0.67 MAOA (0.48) TSHRMAOAMAOBCYP3A4ALOX15
SCHEMBL17044686 0.66 MAOA (0.44) MAOAMAOBLMNAMEN1KMT2A
SCHEMBL58239 0.65 MAOA (0.47) TSHRMAOAMAOBALDH1A1CYP2C19
SCHEMBL18546613 0.65 MAOA (0.47) TSHRMAOAMAOBCYP3A4ALOX15
SCHEMBL5143592 0.65 TDP1 (0.57) TSHRCYP2C9CYP1A2ALDH1A1SMN1; SMN2
SCHEMBL9647298 0.65 MAOA (0.42) TSHRMAOAMAOBCYP3A4ALOX15
SCHEMBL17594174 0.65 THRB (0.51) TSHRMAOAMAOBCYP2C9CYP1A2

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
EP-0435794-A1 Alkenyl- or heteroaryl thio, sulfone, sulfoxy herbicides RHONE-POULENC AGROCHIMIE (FR) 1991-07-03 EP disclosed