SCHEMBL9542822

SCHEMBL9542822

[Pt].c1ccc(Pc2ccccc2)cc1.c1ccc(Pc2ccccc2)cc1.c1ccc(Pc2ccccc2)cc1.c1ccc(Pc2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CA12 O43570 1/20 0.41
GLA P06280 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ALDH1A1 P00352 4/20 0.38
TSHR P16473 5/20 0.33
ALOX12 P18054 2/20 0.33
LMNA P02545 1/20 0.33
ACHE P22303 1/20 0.33
MMP3 P08254 1/20 0.33
BCL2L1 Q07817 1/20 0.33
CA7 P43166 1/20 0.33
HSD17B10 Q99714 2/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32

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
Benzene SCHEMBL28239903 0.96 TDP1 (0.44) TDP1CA1CA2CA9CA12
SCHEMBL49343 0.96 TDP1 (0.44) TDP1CA1CA2CA9CA12
SCHEMBL28047489 0.96 TDP1 (0.44) TDP1CA1CA2CA9CA12
Benzene SCHEMBL4445625 0.96 TDP1 (0.44) TDP1CA1CA2CA9CA12
Benzene SCHEMBL28943358 0.96 TDP1 (0.44) TDP1CA1CA2CA9CA12
Ammonia Solution, Strong SCHEMBL23797888 0.92 TDP1 (0.41) TDP1CA1CA2CA9CA12
Iodide SCHEMBL2939093 0.92 TDP1 (0.41) TDP1CA1CA2CA9CA12
Methane SCHEMBL8857655 0.92 TDP1 (0.41) TDP1CA1CA2CA9CA12
SCHEMBL21597051 0.92 TDP1 (0.41) TDP1CA1CA2CA9CA12
SCHEMBL21597050 0.92 TDP1 (0.41) TDP1CA1CA2CA9CA12

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5310752-A None JP disclosed
JP-5178866-A None JP disclosed
JP-H05310752-A BIS@(3754/24)1,2-BISSILYLETHYLENE)COMPOUND, SILICON-CONTAINING STEPLADDER POLYMER, ITS PRODUCTION AND MATERIALS USING THE SAME AGENCY OF IND SCIENCE & TECHNOL 1993-11-22 JP disclosed
JP-H05178866-A N,1-BISSILYLENAMINE DERIVATIVE AND N,1-BISSILYLIMINE DERIVATIVE AND THEIR PRODUCTION AGENCY OF IND SCIENCE & TECHNOL 1993-07-20 JP disclosed