Methylphenylsulfide

Methylphenylsulfide

SCHEMBL9409875

CC(S)S.CSC.CSc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.41
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
KIF11 P52732 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
AKR1C3 P42330 4/20 0.37
AKR1C2 P52895 4/20 0.37
AKR1C1 Q04828 1/20 0.37
CES1 P23141 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
ALDH1A1 P00352 2/20 0.36

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
Methylphenylsulfide SCHEMBL21802110 0.91 DPP4 (0.38) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL22558244 0.89 DPP4 (0.37) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL2529222 0.89 CES1 (0.45) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL19639862 0.83 DPP4 (0.39) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL20533389 0.83 ACHE (0.44) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL1673145 0.83 KIF11 (0.38) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL20511991 0.82 ACHE (0.42) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL21903711 0.81 DPP4 (0.38) DPP4DPP8DPP9DPP7KIF11
Methylphenylsulfide SCHEMBL10524350 0.79 KIF11 (0.38) DPP4DPP8DPP9DPP7KIF11
Trifluoroacetic Acid SCHEMBL5571447 0.78 CA12 (0.44) DPP4DPP7CES1CYP1A2CYP2D6

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-0618221-A2 Heterocyclic inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 1994-10-05 EP disclosed