SCHEMBL2821991

SCHEMBL2821991

CCOC(=O)c1sc2cc(NC(=O)c3nc(Cl)c(CC)[nH]3)ccc2c1CC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.43
MAPT P10636 9/20 0.41
TP53 P04637 3/20 0.41
RXFP1 Q9HBX9 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.39
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
HTT P42858 2/20 0.39
HPGD P15428 2/20 0.39
GAA P10253 1/20 0.39
DHODH Q02127 1/20 0.38
LMNA P02545 4/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
MCL1 Q07820 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 2/20 0.36

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
SCHEMBL2827008 0.89 TOP2A (0.44) TOP2AMAPTRXFP1SMN1; SMN2ALDH1A1
SCHEMBL2823751 0.82 TOP2A (0.45) TOP2AMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2821759 0.78 CDC7 (0.52) TOP2AMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2822196 0.75 CDC7 (0.52) TOP2AMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2826834 0.74 TOP2A (0.46) TOP2ASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL2822414 0.71 OGA (0.40) TOP2AMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL2822885 0.71 NPC1 (0.56) MAPTSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL2821488 0.70 TARBP2 (0.55) TOP2AMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2825505 0.69 KDM4E (0.51) TOP2AMAPTRXFP1ALDH1A1HTT
SCHEMBL2824300 0.69 LMNA (0.45) MAPTTP53SMN1; SMN2ALDH1A1NPC1

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 TOP2A 3/4885MAPT 1455/4885TP53 370/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A TOP2A 3/4885MAPT 1979/4885TP53 501/4885

“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.