SCHEMBL8469287

SCHEMBL8469287

OP(=S)(SCc1ccccc1)SCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
IDO1 P14902 3/20 0.43
NOS1 P29475 2/20 0.43
NOS3 P29474 1/20 0.43
NOS2 P35228 1/20 0.43
ALPL P05186 1/20 0.40
ALPI P09923 1/20 0.40
ALPG P10696 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2C19 P33261 1/20 0.39
TSHR P16473 2/20 0.39
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAOB P27338 1/20 0.37
DAO P14920 1/20 0.37
CTSL P07711 1/20 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
SCHEMBL7079371 0.86 CA12 (0.45) CA12CA1CA2CA9IDO1
SCHEMBL7074459 0.83 CA12 (0.42) CA12CA1CA2CA9IDO1
SCHEMBL3070009 0.83 IDO1 (0.45) CA12CA1CA2CA9IDO1
SCHEMBL6686598 0.81 CA12 (0.41) CA12CA1CA2CA9IDO1
SCHEMBL6681928 0.77 ALPL (0.47) CA12CA1CA2CA9IDO1
SCHEMBL6831192 0.77 ALPL (0.47) CA12CA1CA2CA9IDO1
SCHEMBL3081281 0.77 CA12 (0.41) CA12CA1CA2CA9IDO1
SCHEMBL3064447 0.77 POLB (0.47) CA12CA1CA2CA9IDO1
SCHEMBL3078061 0.77 CA12 (0.41) CA12CA1CA2CA9IDO1
SCHEMBL5449674 0.77 TSHR (0.52) CA12CA1CA2CA9IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5942470-A OIL SOLUBLE SULFUR CONTAINING PRESSURE AND ANTI-WEAR AGENT, AMINE SALT OF PHOSPHORUS ESTER, SUCCINIMIDE, AND ASHLESS DISPERSANTS ETHYL PETROLEUM ADDITIVES, INC. (US) 1999-08-24 US disclosed
EP-0459656-B1 Lubricant compositions ETHYL PETROLEUM ADDITIVES INC (US) 1995-09-20 EP disclosed
EP-0459656-A1 Lubricant compositions ETHYL PETROLEUM ADDITIVES, INC. (US) 1991-12-04 EP disclosed