SCHEMBL6684403

SCHEMBL6684403

O=P(O)(Cc1ccccc1)SCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.44
ALPL P05186 1/20 0.44
ALPI P09923 1/20 0.44
ALPG P10696 1/20 0.44
HTT P42858 1/20 0.44
TSHR P16473 2/20 0.42
FDPS P14324 2/20 0.41
LMNA P02545 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41
CA9 Q16790 1/20 0.41
LAP3 P28838 3/20 0.40
ANPEP P15144 1/20 0.40
CYP2C19 P33261 1/20 0.40
ACP3 P15309 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
SCHEMBL7079365 0.82 HPGD (0.45) HPGDSMN1; SMN2ALPLALPIALPG
SCHEMBL6681928 0.81 ALPL (0.47) HPGDSMN1; SMN2ALPLALPIALPG
SCHEMBL6831192 0.81 ALPL (0.47) HPGDSMN1; SMN2ALPLALPIALPG
SCHEMBL6831660 0.78 HPGD (0.50) HPGDTSHRFDPSCA12CA1
SCHEMBL6686597 0.78 HPGD (0.45) HPGDSMN1; SMN2ALPLALPIALPG
SCHEMBL6830707 0.77 HPGD (0.43) HPGDSMN1; SMN2ALPLALPIALPG
SCHEMBL7074455 0.77 HPGD (0.43) HPGDSMN1; SMN2ALPLALPIALPG
Benzylphosphonic Acid SCHEMBL11480021 0.76 HPGD (0.58) HPGDTSHRLAP3ANPEPACP3
SCHEMBL6686598 0.76 CA12 (0.41) HPGDSMN1; SMN2ALPLALPIALPG
SCHEMBL3067247 0.74 TSHR (0.42) HPGDSMN1; SMN2ALPLALPIALPG

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
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed