SCHEMBL6967633

SCHEMBL6967633

CCNC(=S)c1c[c]ccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
GAA P10253 5/20 0.35
MAPT P10636 4/20 0.35
ALDH1A1 P00352 5/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALPL P05186 1/20 0.34
ALOX12 P18054 1/20 0.34
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL6971704 0.79 GAA (0.35) GAAALDH1A1HPGDNPSR1TDP1
SCHEMBL158021 0.79 GAA (0.41) POLBMEN1KMT2ACYP1A2CYP2C19
SCHEMBL6967216 0.77 POLB (0.42) POLBMEN1KMT2AGAAMAPT
SCHEMBL10973768 0.77 POLB (0.67) POLBMEN1KMT2AGAAMAPT
SCHEMBL6971199 0.75 NPSR1 (0.34) CYP1A2CYP2C19GAAALDH1A1HPGD
SCHEMBL6965156 0.72 MAPT (0.48) POLBKMT2AGAAMAPTALDH1A1
SCHEMBL1490709 0.69 L3MBTL1 (0.55) POLBKMT2AGAAALDH1A1HPGD
SCHEMBL6971606 0.69
SCHEMBL687760 0.68 MAPT (0.46) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL8994450 0.67 ALDH1A1 (0.35) POLBMEN1KMT2ACYP2C19GAA

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