SCHEMBL6965156

SCHEMBL6965156

CCNC(=S)Nc1c[c]ccc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
ALDH1A1 P00352 6/20 0.48
GAA P10253 4/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 4/20 0.45
ALOX12 P18054 2/20 0.44
HTT P42858 2/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 1/20 0.43
KDM4C Q9H3R0 1/20 0.42

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
SCHEMBL6960682 0.81 MAPT (0.53) MAPTALDH1A1GAAKMT2AALOX12
SCHEMBL1419116 0.80 EPHX1 (0.43) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL7941329 0.79 ALDH1A1 (0.53) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL1275764 0.78 KMT2A (0.72) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL6973539 0.77 TAS2R38 (0.57) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL15675434 0.73 ALDH1A1 (0.68) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL359542 0.72 GAA (0.54) MAPTALDH1A1GAAKMT2ALMNA
SCHEMBL6967633 0.72 POLB (0.42) MAPTALDH1A1GAAKMT2AKDM4E
SCHEMBL468076 0.72
SCHEMBL7102655 0.72 MAOB (0.53) MAPTALDH1A1GAAKMT2A

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-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed