SCHEMBL2848528

SCHEMBL2848528

CCOC(=O)c1cnc(N2CC[C@@H](N)[C@@H](OC)C2)s1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABCC2 Q92887 1/20 0.46
OGA O60502 2/20 0.46
TMPRSS15 P98073 6/20 0.44
CCNT1 O60563 1/20 0.44
CDK9 P50750 1/20 0.44
HRH3 Q9Y5N1 2/20 0.41
OPRK1 P41145 1/20 0.41
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40

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
SCHEMBL2848527 1.00 ABCC2 (0.46) ABCC2OGATMPRSS15CCNT1CDK9
SCHEMBL13248235 0.89 HRH3 (0.51) ABCC2TMPRSS15HRH3OPRK1
Hydrochloric Acid SCHEMBL3107448 0.88 HRH3 (0.50) ABCC2TMPRSS15HRH3OPRK1
Hydrochloric Acid SCHEMBL15121852 0.88 HRH3 (0.50) ABCC2TMPRSS15HRH3OPRK1
SCHEMBL31281641 0.82 HRH3 (0.53) OGATMPRSS15CCNT1CDK9HRH3
SCHEMBL2822653 0.81 OGA (0.50) OGATMPRSS15CCNT1CDK9HRH3
SCHEMBL2852772 0.80 OPRK1 (0.40) ABCC2OPRK1
SCHEMBL2852775 0.80 OPRK1 (0.40) ABCC2OPRK1
SCHEMBL2826190 0.78 ABCC2 (0.56) ABCC2
SCHEMBL2822524 0.78 ABCC2 (0.58) ABCC2CCNT1CDK9

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 ABCC2 1441/4885OGA 2978/4885TMPRSS15 530/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A ABCC2 849/4885OGA 3215/4885TMPRSS15 181/4885

“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.