SCHEMBL12500192

SCHEMBL12500192

CNc1nccc(CN2CCCC2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 4/20 0.40
▸ NCF1 P14598 1/20 0.40
▸ JAK2 O60674 2/20 0.38
▸ JAK3 P52333 2/20 0.38
▸ PDCD1 Q15116 2/20 0.38
▸ CD274 Q9NZQ7 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CCNC P24863 2/20 0.37
▸ CDK8 P49336 2/20 0.37
▸ MKNK1 Q9BUB5 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ HRH3 Q9Y5N1 2/20 0.36
▸ CHRNB2 P17787 1/20 0.36
▸ CHRNA4 P43681 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ MAPK13 O15264 1/20 0.35

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
SCHEMBL7988856 0.84 HRH4 (0.50) CXCR4JAK2JAK3HRH3
SCHEMBL27806578 0.73 KDM4E (0.49) CXCR4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL805468 0.73 PDE6D (0.38) MAPK13MAPK12MAPK11MAPK14
SCHEMBL1787663 0.72 HDAC1 (0.40) MAPK13MAPK12MAPK11MAPK14
SCHEMBL20379433 0.72 CCR1 (0.39) MAPK13MAPK12MAPK11MAPK14
SCHEMBL3150604 0.72 AKT3 (0.40) MAPK13MAPK12MAPK11MAPK14
SCHEMBL28112390 0.70 PDE6D (0.39) KDM4EMAPK13MAPK12MAPK11MAPK14
SCHEMBL12499912 0.69 RXRA (0.35) MAPK13MAPK12MAPK11MAPK14
SCHEMBL15360316 0.69 CYP1A2 (0.41) KDM4EALDH1A1HPGDMKNK1MAPT
SCHEMBL15360315 0.69 NOS3 (0.42) CYP2C19MAPTMAPK13MAPK12MAPK11

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-20130289013-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS SUNOVION PHARMACEUTICALS INC. 2013-10-31 — — US disclosed
US-20110166146-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS SUNOVION PHARMACEUTICALS INC. (US) 2011-07-07 — — 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 (2 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-20110166146-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS PAICS, ITPA, DPYD CXCR4 1406/4885NCF1 1917/4885JAK2 951/4885
US-20130289013-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS PAICS, ITPA, DPYD CXCR4 1406/4885NCF1 1917/4885JAK2 951/4885

“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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