SCHEMBL11868024

SCHEMBL11868024

CCCCCCS(=O)(=O)c1nnc(NC(=O)Nc2ccc(Cl)c(Cl)c2)s1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.65
CA2 P00918 3/20 0.65
HTT P42858 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
BLM P54132 4/20 0.51
LMNA P02545 3/20 0.51
POLB P06746 3/20 0.51
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
DNMT1 P26358 1/20 0.51
DUSP3 P51452 1/20 0.51
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
MCL1 Q07820 1/20 0.51
WRN Q14191 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
CA7 P43166 1/20 0.51

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
SCHEMBL8565680 0.78 MAPT (0.60) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL11871659 0.78 HTT (0.57) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL8569537 0.74 HTT (1.00) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL8561964 0.73 HTT (0.75) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL8559872 0.72 HTT (0.73) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL8563911 0.71 RAB9A (0.74) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL8777974 0.70 EPHX2 (0.80) HTTMEN1KMT2AALDH1A1EPHX2
SCHEMBL8563248 0.70 HTT (0.65) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL11875081 0.69 BLM (0.80) CA1CA2HTTSMN1; SMN2MEN1
SCHEMBL8561139 0.69 HTT (0.67) CA1CA2HTTSMN1; SMN2MEN1

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
US-3990879-A SUBSTITUTED 1-THIADIAZOLYL-3-ARYL-UREAS ELI LILLY AND COMPANY (US) 1976-11-09 US disclosed