SCHEMBL2823781

SCHEMBL2823781

COC(=O)c1nc(-c2ccc(N)c(C)c2)oc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 6/20 0.51
PDCD4 Q53EL6 1/20 0.50
ALDH1A1 P00352 5/20 0.48
HPGD P15428 4/20 0.48
HSD17B10 Q99714 4/20 0.48
KDM4E B2RXH2 3/20 0.48
PKM P14618 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TP53 P04637 2/20 0.45
NPC1 O15118 2/20 0.45
ALOX12 P18054 1/20 0.45
HAVCR2 Q8TDQ0 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 2/20 0.43
TDP1 Q9NUW8 2/20 0.42
POLB P06746 1/20 0.42
IKBKB O14920 4/20 0.42
SLC9A1 P19634 2/20 0.41

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
SCHEMBL2825082 0.87 TARBP2 (0.51) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL2826477 0.83 TARBP2 (0.58) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL6504455 0.80 TARBP2 (0.74) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL16005327 0.80 TARBP2 (0.55) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL6506172 0.78 TARBP2 (0.58) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL16399092 0.78 TARBP2 (0.75) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL2778345 0.77 TARBP2 (0.70) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL2822458 0.77 TARBP2 (0.54) TARBP2PDCD4ALDH1A1HPGDHSD17B10
SCHEMBL2822740 0.76 HDAC1 (0.48) ALDH1A1HPGDHSD17B10RAB9ASMN1; SMN2
SCHEMBL18003401 0.76 SLC9A1 (0.63) TARBP2PDCD4ALDH1A1HPGDHSD17B10

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 TARBP2 1683/4885PDCD4 325/4885ALDH1A1 3596/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A TARBP2 2211/4885PDCD4 424/4885ALDH1A1 1220/4885

“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.