SCHEMBL11200796

SCHEMBL11200796

C=CCS(=O)(=O)c1cnc(O)nc1C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.33
LMNA P02545 2/20 0.33
KMT2A Q03164 2/20 0.33
PDXK O00764 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CDK1 P06493 1/20 0.31
CDK2 P24941 1/20 0.31
KDR P35968 1/20 0.31
HPGD P15428 1/20 0.30
AOX1 Q06278 1/20 0.30

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
Ethane SCHEMBL27745214 0.66 HPGD (0.48) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL27680552 0.66 ALDH1A1 (0.39) ALDH1A1KDM4EMEN1LMNAKMT2A
Sulfuric Acid SCHEMBL5691204 0.65 KDM4E (0.32) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL11201777 0.65 L3MBTL1 (0.38) ALDH1A1KDM4EMEN1KMT2APDXK
SCHEMBL27293077 0.65 ALDH1A1 (0.63) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL29184427 0.62 POLB (0.33) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL707747 0.62 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL11079398 0.62 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1LMNAKMT2A
SCHEMBL1708582 0.61
SCHEMBL9280733 0.59 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1LMNAKMT2A

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-0022511-B1 O-PYRIMIDINYL ESTERS OF N,N-DIMETHYL CARBAMIC ACID, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS PARASITICIDES BAYER AG (DE) 1983-03-09 EP disclosed