SCHEMBL7571864

SCHEMBL7571864

COC(=O)c1sc2cc(C(N)=O)ccc2c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
MAPT P10636 4/20 0.46
MAPK1 P28482 3/20 0.46
GLA P06280 3/20 0.46
ALOX15 P16050 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 3/20 0.45
PRNP P04156 1/20 0.45
TSHR P16473 1/20 0.45
PPARG P37231 1/20 0.45
MAPK10 P53779 1/20 0.45
NCOA2 Q15596 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
GAA P10253 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44

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
SCHEMBL7491144 0.87 MAOB (0.45) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL3205578 0.82 LCK (0.42) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL13926048 0.81 BCL2L1 (0.51) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL4121216 0.79 MAPT (0.45) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL29445467 0.79 MAPT (0.45) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL2578736 0.79 RXFP1 (0.53) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL3205728 0.78 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL4126172 0.78 KDM4E (0.46) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL7555803 0.77 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL693338 0.76 MAPT (0.51) KDM4EALDH1A1HPGDHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0918768-B1 AROMATIC AMIDINE DERIVATIVES USEFUL AS SELECTIVE THROMBIN INHIBITORS C & C RES LAB (KR) 2002-01-09 EP disclosed
US-6201006-B1 ANTICOAGULANTS C & C RESEARCH LABORATORIES (KR) 2001-03-13 US disclosed