SCHEMBL9564314

SCHEMBL9564314

Oc1cccc(I)c1-c1c(Cl)cccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.40
ALOX15 P16050 4/20 0.40
TDP1 Q9NUW8 4/20 0.40
HSP90AA1 P07900 3/20 0.40
LMNA P02545 3/20 0.40
HSD17B10 Q99714 3/20 0.40
RECQL P46063 2/20 0.40
ADAMTS4 O75173 1/20 0.40
EGFR P00533 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
FYN P06241 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
CA6 P23280 1/20 0.40
CDK2 P24941 1/20 0.40
MMP12 P39900 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
SCHEMBL11267122 0.98 TSHR (0.46) TSHRALDH1A1HPGDALOX15TDP1
SCHEMBL14801809 0.86 ALOX15 (0.45) TSHRALDH1A1HPGDALOX15TDP1
SCHEMBL4997683 0.84 TSHR (0.59) TSHRALDH1A1HPGDALOX15TDP1
2,6-Dichlorophenol SCHEMBL142668 0.78 ALDH1A1 (0.52) TSHRALDH1A1HPGDALOX15TDP1
SCHEMBL4961126 0.77 IDO1 (0.41) TSHRALDH1A1HPGDALOX15TDP1
2,6-Dichlorophenol SCHEMBL45346 0.77 ALDH1A1 (0.50) TSHRALDH1A1HPGDALOX15TDP1
SCHEMBL1423760 0.77
SCHEMBL17448425 0.74 TRPA1 (0.48) TSHRALDH1A1HPGDALOX15TDP1
SCHEMBL5948479 0.74 TSHR (0.54) TSHRALDH1A1HPGDALOX15TDP1
2-Chlorophenol SCHEMBL3835310 0.73 ALDH1A1 (0.71) TSHRALDH1A1HPGDALOX15TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0542107-A1 Detection of analytes in saliva using peroxide-peroxidase test systems MILES INC. (US) 1993-05-19 EP disclosed