SCHEMBL2823230

SCHEMBL2823230

CCc1[nH]c(C(=O)N(C)C2CCN(c3nc(C)c(C(=O)O)s3)CC2)nc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.43
PIK3CB P42338 2/20 0.43
PIK3CA P42336 1/20 0.43
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
PPARA Q07869 1/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 1/20 0.33
ABCC2 Q92887 2/20 0.32
CYP3A4 P08684 1/20 0.32
TP53 P04637 1/20 0.31
USP2 O75604 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL2823407 0.91 PIK3CD (0.40) PIK3CDPIK3CBPIK3CAALDH1A1SMN1; SMN2
SCHEMBL2821591 0.90 ALDH1A1 (0.39) PIK3CDPIK3CBPIK3CAALDH1A1SMN1; SMN2
SCHEMBL2826798 0.88 PIK3CD (0.41) PIK3CDPIK3CBPIK3CAALDH1A1SMN1; SMN2
SCHEMBL2822685 0.82 PIK3CD (0.44) PIK3CDPIK3CBPIK3CAALDH1A1SMN1; SMN2
SCHEMBL2824283 0.81 PIK3CD (0.38) PIK3CDPIK3CBPIK3CAALDH1A1SMN1; SMN2
SCHEMBL2823758 0.81 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2GAAKDM4EMAPT
SCHEMBL2827201 0.79 PIK3CD (0.37) PIK3CDPIK3CBPIK3CAALDH1A1HPGD
SCHEMBL2823383 0.79 PIK3CD (0.37) PIK3CDPIK3CBPIK3CAALDH1A1HPGD
SCHEMBL2823275 0.79 ALDH1A1 (0.37) PIK3CDPIK3CBPIK3CAALDH1A1SMN1; SMN2
SCHEMBL2826612 0.79 ABCC2 (0.41) PIK3CDPIK3CBPIK3CAGAAPPARA

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 15 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
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-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-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-8536197-B2 Imidazole carbonyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-09-17 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
US-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-12-09 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
EP-2226322-A1 IMIDAZOLE CARBONYL COMPOUND Daiichi Sankyo Company, Limited (JP) 2010-09-08 EP disclosed
WO-2009084614-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-09 WO 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 PIK3CD 2064/4885PIK3CB 1120/4885PIK3CA 2391/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A PIK3CD 1120/4885PIK3CB 551/4885PIK3CA 882/4885

“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.