SCHEMBL217433

SCHEMBL217433

OCc1cc(-c2ccc3nc(-c4cnc5[nH]ccc5c4)cn3c2)cs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.46
CDK8 P49336 5/20 0.42
RIPK1 Q13546 4/20 0.41
PIK3CA P42336 2/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
CYP2C9 P11712 1/20 0.39
NR4A2 P43354 1/20 0.39
KCNH2 Q12809 1/20 0.39
AXL P30530 2/20 0.38
ITK Q08881 3/20 0.36
BTK Q06187 2/20 0.36
ALDH1A3 P47895 2/20 0.36
PIK3R1 P27986 1/20 0.36
ALDH1A2 O94788 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PLK4 O00444 1/20 0.35
CHEK1 O14757 1/20 0.35
PDPK1 O15530 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
SCHEMBL217897 0.85 NR4A2 (0.41) CYP2C9NR4A2KCNH2ALDH1A3ALDH1A2
SCHEMBL217708 0.82 ALDH1A3 (0.42) PIK3CAPIK3CDCYP2C9NR4A2KCNH2
SCHEMBL3431534 0.81 CDK8 (0.68) LRRK2CDK8CYP2C9NR4A2KCNH2
Hydrochloric Acid SCHEMBL218759 0.81 ALDH1A3 (0.41) PIK3CAPIK3CDCYP2C9NR4A2KCNH2
SCHEMBL218228 0.79 NR4A2 (0.42) CYP2C9NR4A2KCNH2ALDH1A3ALDH1A2
SCHEMBL216667 0.79 CDK8 (0.50) LRRK2CDK8RIPK1PIK3CAPIK3CD
SCHEMBL218890 0.78 ALDH1A3 (0.56) CYP2C9NR4A2KCNH2ALDH1A3ALDH1A2
SCHEMBL219585 0.78 ALDH1A3 (0.61) CYP2C9NR4A2KCNH2ALDH1A3ALDH1A2
SCHEMBL218631 0.78 NR4A2 (0.42) CYP2C9NR4A2KCNH2ALDH1A3ALDH1A2
SCHEMBL220168 0.78 NR4A2 (0.47) CYP2C9NR4A2KCNH2ALDH1A3ALDH1A2

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
EP-2262804-B1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- A] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-12-03 EP claimed
US-8598166-B2 Polysubstituted derivatives of 6-heteroarylimidazo[1,2-a]pyridines, and preparation and therapeutic use thereof SANOFI (FR) 2013-12-03 US claimed
US-8088765-B2 Polysubstituted derivatives of 6-heteroarylimidazo[1,2-a]pyridines, and preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2012-01-03 US claimed
US-20110065700-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYLIMIDAZO[1,2-a]PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-03-17 US claimed
EP-2262804-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- A] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-aventis (FR) 2010-12-22 EP claimed
WO-2009144392-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYL-IMIDAZO[L,2- Α] PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-12-03 WO claimed
US-20120053202-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYLIMIDAZO[1,2-a]PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2012-03-01 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-20110065700-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYLIMIDAZO[1,2-a]PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF CYP4X1, HAX1, JAK2 LRRK2 2114/4885CDK8 2444/4885RIPK1 4420/4885
US-20120053202-A1 POLYSUBSTITUTED DERIVATIVES OF 6-HETEROARYLIMIDAZO[1,2-a]PYRIDINES, AND PREPARATION AND THERAPEUTIC USE THEREOF CYP4X1, HAX1, JAK2 LRRK2 2114/4885CDK8 2444/4885RIPK1 4420/4885

“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.