SCHEMBL9621812

SCHEMBL9621812

[O-][S+](c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 8/20 0.50
TSHR P16473 6/20 0.50
CYP3A4 P08684 4/20 0.50
TTR P02766 3/20 0.50
RECQL P46063 3/20 0.50
ALDH1A1 P00352 2/20 0.50
THRB P10828 3/20 0.46
ALOX15 P16050 3/20 0.44
ALOX12 P18054 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HIF1A Q16665 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 6/20 0.40
MAPK1 P28482 3/20 0.40
CASP1 P29466 2/20 0.38
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
EGFR P00533 2/20 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
SCHEMBL11387726 0.78 ALDH1A1 (0.45) HSD17B10TSHRCYP3A4ALDH1A1HPGD
SCHEMBL69521 0.73 HSD17B10 (0.50) HSD17B10TSHRCYP3A4ALDH1A1SMN1; SMN2
SCHEMBL29904874 0.70 HSD17B10 (0.40) HSD17B10TSHRCYP3A4TTRRECQL
SCHEMBL8640503 0.70 HSD17B10 (0.54) HSD17B10TSHRCYP3A4TTRRECQL
SCHEMBL5372785 0.70 HSD17B10 (0.40) HSD17B10TSHRCYP3A4TTRRECQL
SCHEMBL11368863 0.69 TSHR (0.50) HSD17B10TSHRCYP3A4RECQLALDH1A1
SCHEMBL5363872 0.69 BACE1 (0.50) HSD17B10CYP3A4ALDH1A1HPGDLMNA
Bithionoloxide SCHEMBL69373 0.69 HSD17B10 (0.56) HSD17B10TSHRCYP3A4TTRRECQL
SCHEMBL727419 0.68 CA1 (0.50) CYP3A4TTRALDH1A1CYP1A2CYP2C19
SCHEMBL8872103 0.67 HSD17B10 (1.00) HSD17B10TSHRCYP3A4TTRRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5128429-A Low temperature block polymerization without randomization RAYCHEM LIMITED (GB) 1992-07-07 US disclosed
EP-0154506-B1 PREPARATION OF ORGANIC POLYMERS RAYCHEM LIMITED (GB) 1992-02-05 EP disclosed
US-4999411-A Polythioethers, polythiocarbonates, polythioamides, polythioimides RAYCHEM LIMITED (GB) 1991-03-12 US disclosed
US-4960835-A ENGINEERING THERMOPLASTICS RAYCHEM LIMITED (GB) 1990-10-02 US disclosed
US-4845179-A CONDENSATION POLYMERIZATION RAYCHEM LIMITED (GB) 1989-07-04 US disclosed
EP-0154506-A2 Preparation of organic polymers RAYCHEM LIMITED (GB) 1985-09-11 EP disclosed