SCHEMBL2823924

SCHEMBL2823924

CCOC(=O)c1cccc(N2CC(N)C2)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
ALOX5 P09917 1/20 0.52
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
CYP4F2 P78329 1/20 0.49
CYP4A11 Q02928 1/20 0.49
ALOX15 P16050 1/20 0.47
PRKCA P17252 1/20 0.47
GSK3B P49841 1/20 0.47
ESRRA P11474 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL2690896 0.90 ATM (0.53) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL2690900 0.90 ATM (0.53) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL2690898 0.90 ATM (0.53) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL14879672 0.88 ATM (0.56) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL6501171 0.87 ATM (0.56) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL14881542 0.83 ALOX5 (0.56) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL2693239 0.82 ATM (0.47) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL6506787 0.82 ATM (0.51) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL14881406 0.82 ALOX5 (0.55) ATMSMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL10144997 0.81 ALOX5 (0.60) ATMSMN1; SMN2ALOX5ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

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

For each of this compound's patents that has machine-readable text (2 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-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A ATM 580/4885SMN1; SMN2 4001/4885ALOX5 4681/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A ATM 1655/4885SMN1; SMN2 3604/4885ALOX5 4275/4885

“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.