SCHEMBL18784152

SCHEMBL18784152

OC(=S)c1ncc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.46
ALDH1A1 P00352 3/20 0.42
LMNA P02545 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TSHR P16473 2/20 0.38
CYP2C9 P11712 1/20 0.38
APEX1 P27695 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR27 Q9NS67 1/20 0.38
MAPK1 P28482 1/20 0.37
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MAPT P10636 1/20 0.33
XBP1 P17861 1/20 0.33
GLA P06280 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP3A4 P08684 1/20 0.32
RECQL P46063 1/20 0.32
GAA P10253 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
SCHEMBL21905409 0.80 PLAU (0.42) PLAUALDH1A1LMNAL3MBTL1TSHR
SCHEMBL9779776 0.79 ALDH1A1 (0.40) PLAUALDH1A1HPGDMAPTGLA
SCHEMBL287761 0.78 LMNA (0.47) PLAUALDH1A1LMNAL3MBTL1TSHR
Hydrochloric Acid SCHEMBL9779721 0.78 ALDH1A1 (0.39) PLAUALDH1A1HPGDMAPTGLA
SCHEMBL23413510 0.77 LMNA (0.46) PLAUALDH1A1LMNAL3MBTL1TSHR
Hydrochloric Acid SCHEMBL20139726 0.77 LMNA (0.46) PLAUALDH1A1LMNAL3MBTL1TSHR
SCHEMBL28002539 0.76 L3MBTL1 (0.44) PLAUALDH1A1LMNAL3MBTL1TSHR
SCHEMBL3580724 0.74 L3MBTL1 (0.43) PLAUALDH1A1LMNAL3MBTL1TSHR
SCHEMBL7692886 0.72 LMNA (0.42) PLAUALDH1A1LMNAL3MBTL1TSHR
SCHEMBL30143410 0.72 PLAU (0.48) PLAUALDH1A1LMNAL3MBTL1TSHR

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-3162795-A1 METHOD FOR MANUFACTURING 3-(ALKYL SULFONYL)PYRIDINE-2-CARBOXYLIC ACID Sumitomo Chemical Company, Limited (JP) 2017-05-03 EP disclosed