SCHEMBL21044752

SCHEMBL21044752

OP(O)(=S)OP(O)(O)=[SH](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA5A P35218 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
SCHEMBL29363071 0.68 SRC (0.44) SRC
SCHEMBL3071997 0.65 SRC (0.50) SRCCA5A
SCHEMBL28450162 0.65 SRC (0.50) SRCCA5A
SCHEMBL3068799 0.64 ALDH1A1 (0.34) SRCESR1ESR2CA2
SCHEMBL3066818 0.64 SRC (0.30) SRCESR1ESR2
SCHEMBL3081698 0.64 KDM4E (0.38)
SCHEMBL852189 0.62 SRC (0.58) SRCCA4CA5A
SCHEMBL3077044 0.62 ESR1 (0.46) SRCESR1ESR2CA2CA4
SCHEMBL3067248 0.61 TSHR (0.55) SRCCA2
SCHEMBL29173758 0.61 CA2 (0.34) SRCCA2CA4CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3492564-B1 GREASE COMPOSITION KYODO YUSHI (JP) 2024-02-28 EP disclosed
EP-3492564-A1 GREASE COMPOSITION Kyodo Yushi Co., Ltd. (JP) 2019-06-05 EP disclosed