SCHEMBL5351835

SCHEMBL5351835

O=P(O)(S)Sc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.44
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA5A P35218 1/20 0.42
SRC P12931 2/20 0.38
CFTR P13569 1/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MGLL Q99685 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PTPN1 P18031 1/20 0.37
FFAR1 O14842 1/20 0.37
TSHR P16473 2/20 0.35
ALOX15 P16050 1/20 0.35
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL707305 0.80 KCNH2 (0.47) KCNH2CA2CA4CA5ASRC
SCHEMBL6827880 0.80 KCNH2 (0.47) KCNH2CA2CA4CA5ASRC
SCHEMBL108542 0.80 KCNH2 (0.47) KCNH2CA2CA4CA5ASRC
SCHEMBL6684937 0.80 KCNH2 (0.47) KCNH2CA2CA4CA5ASRC
Hydrochloric Acid SCHEMBL4656192 0.78 KCNH2 (0.45) KCNH2CA2CA4CA5ASRC
SCHEMBL3071995 0.77 KCNH2 (0.42) KCNH2CA2CA4CA5ASRC
SCHEMBL6827883 0.76 MAPT (0.38) KCNH2CA2CA4CA5AHPGD
SCHEMBL3077639 0.76 KCNH2 (0.44) KCNH2CA2CA4CA5AHPGD
SCHEMBL2502560 0.75 KCNH2 (0.47) KCNH2CA2CA4CA5ASRC
SCHEMBL634506 0.74 KCNH2 (0.42) KCNH2CA2CA4CA5ACFTR

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-7235142-B2 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON (US) 2007-06-26 US disclosed
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