SCHEMBL11021037

SCHEMBL11021037

Cc1nc(NC(C)C)sc1-c1cc(C#N)c(=O)[nH]c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.49
RXFP1 Q9HBX9 1/20 0.49
PDE3A Q14432 5/20 0.46
PDE3B Q13370 4/20 0.46
HPGD P15428 3/20 0.46
PDE4A P27815 2/20 0.46
BLM P54132 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE5A O76074 1/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46
PTGS1 P23219 1/20 0.46
CYP2C19 P33261 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
ALDH1A1 P00352 2/20 0.45
GALR3 O60755 1/20 0.45
GAA P10253 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL11053386 0.83 PIK3CG (0.55) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL11019345 0.79 KDM4E (0.57) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL11028624 0.78 MEN1 (0.51) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL11052554 0.75 KDM4E (0.45) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL10854963 0.70 KDM4E (0.52) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL10855611 0.69 KDM4E (0.60) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL10856534 0.68 KDM4E (0.73) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL11020308 0.68 KDM4E (0.73) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL11020857 0.68 PDE3B (0.52) KDM4ERXFP1PDE3APDE3BHPGD
SCHEMBL10910836 0.67 PDE3A (0.67) KDM4ERXFP1PDE3APDE3BHPGD

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-0154190-A1 Pyridones MERCK PATENT GmbH (DE) 1985-09-11 EP disclosed