SCHEMBL6830628

SCHEMBL6830628

OP(=S)(Cc1ccccc1)SS

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
TSHR P16473 3/20 0.36
IDO1 P14902 1/20 0.36
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
FDPS P14324 1/20 0.34
MGLL Q99685 1/20 0.34
LAP3 P28838 3/20 0.33
ANPEP P15144 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX12 P18054 1/20 0.33
CALM1 P0DP23 1/20 0.33

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
SCHEMBL6681829 0.78 HPGD (0.46) HPGDTSHRIDO1CA12CA1
SCHEMBL6686598 0.78 CA12 (0.41) HPGDTSHRIDO1CA12CA1
SCHEMBL6831660 0.75 HPGD (0.50) HPGDTSHRCA12CA1CA2
SCHEMBL6310524 0.75 HPGD (0.48) HPGDTSHRIDO1FDPSLAP3
SCHEMBL6681698 0.72 IDO1 (0.46) HPGDTSHRIDO1TDP1ALDH1A1
SCHEMBL7074459 0.71 CA12 (0.42) HPGDTSHRIDO1CA12CA1
SCHEMBL3083784 0.71 TSHR (0.53) TSHRIDO1CA12CA1CA2
SCHEMBL3074312 0.71 CA12 (0.35) HPGDIDO1CA12CA1CA2
SCHEMBL3072609 0.70 HPGD (0.43) HPGDTSHRIDO1CA12CA1
SCHEMBL3069833 0.70 HPGD (0.43) HPGDTSHRCA12CA1CA2

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-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed