SCHEMBL13764181

SCHEMBL13764181

CCCNc1nccn2cc(C(=O)OCC)nc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.51
ALDH1A1 P00352 5/20 0.51
HPGD P15428 4/20 0.51
POLB P06746 1/20 0.45
GAA P10253 1/20 0.38
TTK P33981 1/20 0.38
CYP1A2 P05177 3/20 0.38
HSD17B10 Q99714 2/20 0.37
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
GABRA2 P47869 4/20 0.37
GABRB2 P47870 4/20 0.37
ADORA2A P29274 1/20 0.36
CYP2C19 P33261 1/20 0.36
EED O75530 1/20 0.35
RBBP4 Q09028 1/20 0.35

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
SCHEMBL13764178 0.86 KDM4E (0.54) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL26092626 0.81 KDM4E (0.59) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL18189912 0.80 KDM4E (0.58) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL13764176 0.79 KDM4E (0.56) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL6934846 0.79 KDM4E (0.56) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL31244472 0.78 KDM4E (0.59) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL18189892 0.77 KDM4E (0.54) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL31285488 0.76 KDM4E (0.56) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL31244541 0.76 KDM4E (0.56) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL14507509 0.74 KDM4E (0.54) KDM4EALDH1A1HPGDPOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090175852-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2009-07-09 US disclosed
US-7557104-B2 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION (US) 2009-07-07 US disclosed
US-20080027063-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2008-01-31 US 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-20080027063-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS CHEK1, CHEK2, CDKN1A KDM4E 857/4885ALDH1A1 3481/4885HPGD 3423/4885
US-20090175852-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS CHEK1, CHEK2, CDKN1A KDM4E 857/4885ALDH1A1 3481/4885HPGD 3423/4885

“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.