SCHEMBL11176830

SCHEMBL11176830

OB(Cl)Oc1ccccc1OB(O)Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 3/20 0.41
ORAI1 Q96D31 4/20 0.39
ORAI2 Q96SN7 4/20 0.39
ORAI3 Q9BRQ5 4/20 0.39
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA4 P22748 2/20 0.35
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
TRPV6 Q9H1D0 3/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
LIPE Q05469 1/20 0.33
PCSK9 Q8NBP7 1/20 0.33
JAK2 O60674 1/20 0.31

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
SCHEMBL29706601 0.77 ENPP2 (0.44) ENPP2ORAI1ORAI2ORAI3CA1
SCHEMBL6678412 0.77 ENPP2 (0.44) ENPP2ORAI1ORAI2ORAI3CA1
SCHEMBL11645561 0.71 CA1 (0.35) ENPP2CA1CA2
SCHEMBL3196704 0.67 ENPP2 (0.37) ENPP2ORAI1ORAI2ORAI3CA1
SCHEMBL2885055 0.67 LMNA (0.42) ENPP2ORAI1ORAI2ORAI3TP53
SCHEMBL2260419 0.67 CA1 (0.62) ENPP2ORAI1ORAI2ORAI3CA1
SCHEMBL30689248 0.67 CA1 (0.62) ENPP2ORAI1ORAI2ORAI3CA1
Potassium SCHEMBL8009526 0.65 LMNA (0.41) ENPP2ORAI1ORAI2ORAI3TP53
SCHEMBL31657742 0.65 ENPP2 (0.39) ENPP2ORAI1ORAI2ORAI3CA1
SCHEMBL5175329 0.64 RXRA (0.42) ENPP2ORAI1ORAI2ORAI3GAA

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
EP-0011456-B1 ORGANOTIN COMPOUNDS AND RESINS OR POLYMERS STABILIZED THEREWITH M & T CHEMICALS, INC. (US) 1983-09-07 EP disclosed
US-4254017-A HEAT STABILIZER FOR POLYVINYL CHLORIDE M&T CHEMICALS INC. (US) 1981-03-03 US disclosed
EP-0011456-A1 Organotin compounds and resins or polymers stabilized therewith M & T CHEMICALS, INC. (US) 1980-05-28 EP disclosed