SCHEMBL2552224

SCHEMBL2552224

COCCn1c(-c2c[nH]c(-c3ccc4scnc4c3)n2)nc2cccc(Cl)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 5/20 0.41
▸ DRD2 P14416 6/20 0.35
▸ GRM5 P41594 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ MAP3K11 Q16584 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ RECQL P46063 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ STK4 Q13043 1/20 0.34
▸ STK3 Q13188 1/20 0.34
▸ SIK2 Q9H0K1 1/20 0.34
▸ STK26 Q9P289 1/20 0.34
▸ STK24 Q9Y6E0 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ PTGER4 P35408 2/20 0.33

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
SCHEMBL2555588 0.86 HPGD (0.49) CASRKDM4ERECQLHSD17B10ALDH1A1
SCHEMBL2548914 0.84 TP53 (0.39) CASRMAP3K11KDM4ERECQLHSD17B10
SCHEMBL2551655 0.84 RIPK2 (0.37) CASRDRD2GRM5MAP3K11KDM4E
SCHEMBL14575714 0.83 NPC1 (0.36) DRD2MAP3K11KDM4ERECQLHSD17B10
SCHEMBL2550186 0.82 CASR (0.39) CASRMAP3K11KDM4ERECQLHSD17B10
SCHEMBL14575953 0.82 NPC1 (0.35) MAP3K11KDM4ERECQLHSD17B10STK4
SCHEMBL14575762 0.82 ALOX15 (0.36) MAP3K11KDM4ERECQLHSD17B10ALDH1A1
SCHEMBL2554816 0.82 KDM4E (0.37) CASRMAP3K11KDM4ERECQLHSD17B10
SCHEMBL2552122 0.81 PTGER4 (0.37) CASRMAP3K11KDM4ERECQLHSD17B10
SCHEMBL14576676 0.81 KDM4E (0.37) CASRMAP3K11KDM4ERECQLHSD17B10

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 7 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 claimed
EP-2552208-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS Glaxo Group Limited (GB) 2013-02-06 — — EP disclosed
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
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 — — US disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 — — WO disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 — — WO 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 CASR 2479/4885DRD2 3938/4885GRM5 3211/4885

“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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