SCHEMBL14616794

SCHEMBL14616794

COCCn1c(-c2cnc(-c3ccc4scnc4c3)[nH]2)nc2cc(C)cnc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 1/20 0.44
▸ MAPK1 P28482 3/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ PIM1 P11309 1/20 0.33
▸ PIM2 Q9P1W9 1/20 0.33
▸ PTGER4 P35408 1/20 0.33
▸ MAP3K11 Q16584 2/20 0.33
▸ HSD17B10 Q99714 5/20 0.32
▸ CYP1A2 P05177 5/20 0.32
▸ CYP3A4 P08684 5/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MTOR P42345 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ GLA P06280 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ SMPD3 Q9NY59 1/20 0.32

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
SCHEMBL14616791 0.89 RIPK2 (0.43) RIPK2MAPK1ALOX15NPC1POLB
SCHEMBL14616792 0.88 RIPK2 (0.43) RIPK2MAPK1ALOX15NPC1POLB
SCHEMBL14616796 0.88 RIPK2 (0.53) RIPK2MAPK1ALOX15NPC1POLB
SCHEMBL14616831 0.86 RIPK2 (0.47) RIPK2MAPK1ALOX15NPC1POLB
SCHEMBL14616834 0.86 RIPK2 (0.44) RIPK2MAPK1ALOX15NPC1POLB
SCHEMBL14616801 0.85 RIPK2 (0.49) RIPK2NPC1RAB9APTGER4HSD17B10
SCHEMBL14575762 0.85 ALOX15 (0.36) RIPK2MAPK1ALOX15NPC1POLB
SCHEMBL14616800 0.83 RIPK2 (0.53) RIPK2MAPK1ALOX15NPC1POLB
SCHEMBL14616799 0.83 RIPK2 (0.51) RIPK2PTGER4HSD17B10KDM4ERECQL
SCHEMBL14616835 0.83 RIPK2 (0.41) RIPK2MAPK1ALOX15NPC1POLB

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 255/4885MAPK1 74/4885ALOX15 4875/4885

“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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