SCHEMBL14576307

SCHEMBL14576307

COCCn1ccnc1-c1c[nH]c(-c2ccc3scnc3c2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 5/20 0.36
▸ MAP3K11 Q16584 1/20 0.35
▸ SYK P43405 1/20 0.35
▸ GRIN2B Q13224 1/20 0.34
▸ KDM1A O60341 1/20 0.34
▸ TGFBR1 P36897 3/20 0.33
▸ DYRK2 Q92630 2/20 0.33
▸ LCK P06239 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ WNT1 P04628 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ TRPV3 Q8NET8 1/20 0.33
▸ PFKFB3 Q16875 2/20 0.32
▸ MCL1 Q07820 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RAB9A P51151 1/20 0.31

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
SCHEMBL14575714 0.83 NPC1 (0.36) RIPK2MAP3K11TGFBR1DYRK2LCK
SCHEMBL2548914 0.83 TP53 (0.39) MAP3K11SYKKDM1ANPC1POLB
SCHEMBL14616832 0.82 RIPK2 (0.37) RIPK2MAP3K11SYKGRIN2BKDM1A
SCHEMBL14575953 0.81 NPC1 (0.35) RIPK2MAP3K11KDM1ATGFBR1DYRK2
SCHEMBL14576676 0.81 KDM4E (0.37) MAP3K11NPC1POLBALOX15MAPK1
SCHEMBL2555588 0.80 HPGD (0.49) NPC1RAB9A
SCHEMBL2554816 0.80 KDM4E (0.37) RIPK2MAP3K11TRPV3NPC1POLB
SCHEMBL14575762 0.80 ALOX15 (0.36) RIPK2MAP3K11TGFBR1DYRK2LCK
SCHEMBL14576187 0.80 MAP3K11 (0.34) RIPK2MAP3K11TGFBR1DYRK2LCK
SCHEMBL2552122 0.79 PTGER4 (0.37) MAP3K11GRIN2BTRPV3PFKFB3NPC1

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 claimed
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 255/4885MAP3K11 19/4885SYK 432/4885

“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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