SCHEMBL2823339

SCHEMBL2823339

CCOC(=O)c1sc(-c2ccc(N)cc2)nc1C

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 9/20 0.73
DBF4 Q9UBU7 9/20 0.73
TRPM8 Q7Z2W7 4/20 0.61
KDM4E B2RXH2 3/20 0.59
MAPT P10636 3/20 0.59
ALDH1A1 P00352 2/20 0.59
LMNA P02545 2/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
HSP90AA1 P07900 1/20 0.55
CRHBP P24387 1/20 0.55
CRHR2 Q13324 1/20 0.55
GAA P10253 3/20 0.51
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
ALOX15 P16050 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HSD17B10 Q99714 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
SCHEMBL892889 0.89 CDC7 (0.77) CDC7DBF4TRPM8KDM4EMAPT
SCHEMBL290384 0.87 CDC7 (0.75) CDC7DBF4TRPM8KDM4EMAPT
SCHEMBL2885887 0.86 TRPM8 (0.78) CDC7DBF4TRPM8KDM4EMAPT
SCHEMBL4464882 0.86 CDC7 (0.73) CDC7DBF4TRPM8KDM4EMAPT
Hydrochloric Acid SCHEMBL28885517 0.86 CDC7 (0.73) CDC7DBF4TRPM8KDM4EMAPT
SCHEMBL2085303 0.86 CDC7 (0.73) CDC7DBF4TRPM8KDM4EMAPT
SCHEMBL2885708 0.86 TRPM8 (0.78) CDC7DBF4TRPM8KDM4EMAPT
SCHEMBL289229 0.86 CDC7 (0.73) CDC7DBF4TRPM8KDM4EMAPT
Bromide SCHEMBL28376005 0.86 CDC7 (0.73) CDC7DBF4TRPM8KDM4EMAPT
SCHEMBL14394992 0.86 CDC7 (0.73) CDC7DBF4TRPM8KDM4EMAPT

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116585297-A Application of sulfonamide derivative 云南大学附属医院 2023-08-15 CN disclosed
EP-2226322-B1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO CO LTD (JP) 2015-01-21 EP disclosed
US-8927588-B2 Imidazole carbonyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-01-06 US disclosed
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-03-13 US disclosed
US-8536197-B2 Imidazole carbonyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-09-17 US disclosed
EP-1727808-B3 BIARYL AMINO ACIDS AND THEIR USE IN DNA BINDING OLIGOMERS SPIROGEN LTD (GB) 2013-01-09 EP disclosed
US-20110160192-A1 BIARYL AMINO ACIDS AND THEIR USE IN DNA BINDING OLIGOMERS SPIROGEN LIMITED (GB) 2011-06-30 US disclosed
US-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-12-09 US disclosed
EP-2226322-A1 IMIDAZOLE CARBONYL COMPOUND Daiichi Sankyo Company, Limited (JP) 2010-09-08 EP disclosed
US-20070249591-A1 Biaryl Amino Acids and Their Use in Dna Binding Oligomers SPIROGEN LIMITED (GB) 2007-10-25 US disclosed
US-20070249591-A1 Biaryl Amino Acids and Their Use in Dna Binding Oligomers SPIROGEN LIMITED (GB) 2007-10-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110160192-A1 BIARYL AMINO ACIDS AND THEIR USE IN DNA BINDING OLIGOMERS PCNA, POLL, XPA CDC7 1328/4885DBF4 1051/4885TRPM8 4568/4885
US-20070249591-A1 Biaryl Amino Acids and Their Use in Dna Binding Oligomers PCNA, POLL, DNA2 CDC7 1291/4885DBF4 1136/4885TRPM8 4574/4885
US-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A CDC7 271/4885DBF4 1344/4885TRPM8 3384/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A CDC7 726/4885DBF4 1228/4885TRPM8 2902/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.