SCHEMBL14616783

SCHEMBL14616783

CNC(=O)c1ccc2nc(-c3cnc(-c4ccc(Cl)cc4)[nH]3)n(CCOC)c2c1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 1/20 0.73
▸ CHEK2 O96017 3/20 0.47
▸ PTGER4 P35408 9/20 0.47
▸ DRD2 P14416 1/20 0.39
▸ TBXA2R P21731 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ SIRT1 Q96EB6 1/20 0.39
▸ SIRT3 Q9NTG7 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ ACSS2 Q9NR19 1/20 0.38
▸ ESR2 Q92731 1/20 0.38

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
SCHEMBL14616775 0.93 RIPK2 (0.84) RIPK2CHEK2PTGER4
SCHEMBL14616784 0.91 RIPK2 (0.71) RIPK2CHEK2PTGER4
SCHEMBL14616781 0.85 RIPK2 (0.64) RIPK2PTGER4TP53MAPTKDM4E
SCHEMBL14616773 0.85 RIPK2 (0.83) RIPK2PTGER4DRD2TBXA2RKDM4E
SCHEMBL14616774 0.85 RIPK2 (1.00) RIPK2PTGER4
SCHEMBL14616785 0.84 RIPK2 (0.70) RIPK2PTGER4
SCHEMBL14616778 0.84 RIPK2 (0.62) RIPK2TP53KDM4EALDH1A1
SCHEMBL14576193 0.83 RIPK2 (0.52) RIPK2CHEK2PTGER4DRD2TBXA2R
SCHEMBL14616776 0.82 RIPK2 (0.78) RIPK2PTGER4
SCHEMBL12284542 0.81 RIPK2 (0.66) RIPK2DRD2TBXA2RTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 — — US disclosed
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 — — 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 (1 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-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K3 RIPK2 255/4885CHEK2 25/4885PTGER4 3190/4885

“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.

Send feedback