SCHEMBL3169771

SCHEMBL3169771

OP(O)(=S)Oc1ccccc1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HRH1 P35367 7/20 0.45
DRD1 P21728 5/20 0.45
DRD2 P14416 4/20 0.45
DRD4 P21917 4/20 0.45
DRD5 P21918 4/20 0.45
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
DRD3 P35462 4/20 0.43
LMNA P02545 1/20 0.43
BCL2 P10415 1/20 0.41
BCL2L1 Q07817 1/20 0.41
SRC P12931 1/20 0.41
SLC5A1 P13866 1/20 0.40
SLC5A2 P31639 1/20 0.40

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
SCHEMBL1099381 0.82 SRC (0.51) HPGDSMN1; SMN2HRH1DRD1DRD2
SCHEMBL15559464 0.82 SRC (0.51) HPGDSMN1; SMN2HRH1DRD1DRD2
SCHEMBL2138155 0.78 HPGD (0.50) HPGDSMN1; SMN2HRH1DRD1DRD2
SCHEMBL7597025 0.75 HPGD (0.51) HPGDSMN1; SMN2HRH1DRD1DRD2
SCHEMBL28929287 0.75 THRA (0.40)
SCHEMBL10538189 0.75 HPGD (0.55) HPGDSMN1; SMN2HRH1DRD1DRD2
SCHEMBL246372 0.74 HPGD (0.58) HPGDSMN1; SMN2HRH1DRD1DRD2
SCHEMBL5478147 0.74 HPGD (0.50) HPGDSMN1; SMN2HRH1DRD1DRD2
SCHEMBL3169777 0.74 LTA4H (0.52) HRH1CYP1A2CYP2C9L3MBTL1LMNA
SCHEMBL5478146 0.74 HPGD (0.50) HPGDSMN1; SMN2HRH1DRD1DRD2

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-20100009878-A1 LUBRICATING OIL COMPOSITION SHOWA SHELL SEKIYU K.K. (JP) 2010-01-14 US disclosed
EP-2092046-A1 LUBRICATING OIL COMPOSITION Showa Shell Sekiyu K. K. (JP) 2009-08-26 EP disclosed
WO-2008090179-A1 LUBRICATING OIL COMPOSITION SHOWA SHELL SEKIYU K.K. (JP) 2008-07-31 WO disclosed