SCHEMBL14616789

SCHEMBL14616789

COCCn1c(-c2c[nH]c(-c3ccc4sccc4c3)n2)nc2cc(C(C)(C)O)ccc21

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 14/20 0.44
▸ RIPK2 O43353 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CASR P41180 1/20 0.34

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
SCHEMBL2551421 0.88 PTGER4 (0.44) PTGER4RIPK2KDM4ERECQLHSD17B10
SCHEMBL14616788 0.85 PTGER4 (0.51) PTGER4RIPK2KDM4E
SCHEMBL14642855 0.80 PTGER4 (0.42) PTGER4RIPK2KDM4ERECQLHSD17B10
SCHEMBL2549694 0.79 CNR2 (0.42) PTGER4RIPK2KDM4ERECQLHSD17B10
SCHEMBL14576556 0.76 CNR2 (0.50) PTGER4RIPK2KDM4ERECQLHSD17B10
SCHEMBL14576508 0.75 PTGER4 (0.37) PTGER4RIPK2KDM4ERECQLHSD17B10
SCHEMBL2552155 0.75 PTGER4 (0.47) PTGER4RIPK2KDM4ERECQLHSD17B10
SCHEMBL2550896 0.74 PTGER4 (0.51) PTGER4RIPK2
SCHEMBL2552835 0.73 PTGER4 (0.50) PTGER4RIPK2KDM4E
SCHEMBL2555588 0.73 HPGD (0.49) PTGER4KDM4ERECQLHSD17B10HPGD

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 PTGER4 3190/4885RIPK2 255/4885KDM4E 764/4885

“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.

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