SCHEMBL10488561

SCHEMBL10488561

NNC(=S)Nc1c(Cl)cccc1Cl

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.77
MAPT P10636 4/20 0.63
LMNA P02545 2/20 0.63
KDM4E B2RXH2 2/20 0.63
ALDH1A1 P00352 2/20 0.63
IDO1 P14902 7/20 0.55
MAPK1 P28482 1/20 0.51
PTPN7 P35236 1/20 0.51
DUSP3 P51452 1/20 0.51
PTPN5 P54829 1/20 0.51
PTPN11 Q06124 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51

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
SCHEMBL8513843 0.87 GAA (1.00) GAAMAPTLMNAKDM4EALDH1A1
SCHEMBL5455257 0.87 GAA (0.58) GAAMAPTALDH1A1MAPK1PTPN7
SCHEMBL5427784 0.79 IDO1 (0.62) GAAMAPTLMNAKDM4EALDH1A1
SCHEMBL11049995 0.79 GAA (0.56) GAAMAPTLMNAALDH1A1MAPK1
SCHEMBL3264509 0.78 GAA (0.50) GAAMAPTLMNAKDM4EALDH1A1
SCHEMBL5430219 0.78 ALDH1A1 (1.00) GAAMAPTLMNAKDM4EALDH1A1
SCHEMBL29488194 0.78 ALDH1A1 (1.00) GAAMAPTLMNAKDM4EALDH1A1
SCHEMBL11074940 0.77 GAA (0.50) GAAMAPTLMNAKDM4EALDH1A1
SCHEMBL11054164 0.77 GAA (0.50) GAAMAPK1PTPN7DUSP3PTPN5
SCHEMBL27876770 0.76 LMNA (1.00) GAAMAPTLMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440065-B1 Electrolyte composition, method, and improved apparatus for high speed tin-silver electroplating TECHNIC, INC. (US) 2013-05-14 US claimed
US-8440065-B1 Electrolyte composition, method, and improved apparatus for high speed tin-silver electroplating TECHNIC, INC. (US) 2013-05-14 US disclosed
US-4871737-A 3-Amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants muscle relaxants and anxiolytics A. H. ROBINS COMPANY, INCORPORATED (US) 1989-10-03 US disclosed
EP-0315433-A2 3-amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants, muscle relaxants and anxiolytics A.H. ROBINS COMPANY, INCORPORATED (US) 1989-05-10 EP disclosed
US-4826866-A 3-amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants, muscle relaxants and anxiolytics A. H. ROBINS COMPANY, INCORPORATED (US) 1989-05-02 US disclosed