SCHEMBL21686853

SCHEMBL21686853

CNCCS(=O)(=O)Nc1cccc(SC)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.55
▸ GAA P10253 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ KMT2A Q03164 5/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ LMNA P02545 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.44
▸ POLB P06746 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ ESR1 P03372 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
SCHEMBL13740768 0.83 HPGD (0.62) HPGDGAAL3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL29143516 0.82 HPGD (0.55) HPGDGAAL3MBTL1KMT2AMEN1
SCHEMBL21686851 0.81 CA12 (0.55) HPGDGAAKMT2AMEN1LMNA
SCHEMBL21686866 0.80 HTT (0.49) HPGDGAAKMT2AMEN1LMNA
SCHEMBL21686864 0.79 ALOX15 (0.47) KMT2AMEN1LMNATSHRSMN1; SMN2
SCHEMBL15601951 0.77 KEAP1 (0.50) HPGDKMT2AMEN1LMNASMN1; SMN2
SCHEMBL21686847 0.77 LMNA (0.51) HPGDKMT2AMEN1LMNATSHR
SCHEMBL13741560 0.76 HPGD (0.66) HPGDGAAL3MBTL1KMT2AMEN1
SCHEMBL21686846 0.75 CDK1 (0.53) GAAKMT2ASMN1; SMN2MAPTTP53
SCHEMBL27183267 0.73 HPGD (0.62) HPGDGAAL3MBTL1KMT2AMEN1

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
WO-2020020939-A1 PYRIDOPYRIMIDINES AS HISTAMINE H4-RECEPTOR INHIBITORS FAES FARMA, S.A. (ES) 2020-01-30 — — WO disclosed
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