SCHEMBL3270210

SCHEMBL3270210

N#Cc1ccc(N2CCC(CNC(=O)OCC(N)=O)CC2)nc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 7/20 0.49
JAK2 O60674 6/20 0.46
JAK3 P52333 6/20 0.46
JAK1 P23458 5/20 0.46
KCNH2 Q12809 5/20 0.46
DPP4 P27487 1/20 0.46
PANK3 Q9H999 1/20 0.45
CHRM2 P08172 2/20 0.44
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
AOC3 Q16853 2/20 0.43
GPR119 Q8TDV5 1/20 0.42

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
SCHEMBL3269155 0.85 CHIT1 (0.42) CHRM4PANK3
SCHEMBL3265671 0.85 DEGS1 (0.49) AOC3GPR119
SCHEMBL3266209 0.85 CKS1B (0.44) PANK3AOC3GPR119
SCHEMBL1729285 0.83 CHRM4 (0.57) CHRM4JAK2JAK3JAK1KCNH2
SCHEMBL3266247 0.83 HRH3 (0.46) AOC3
SCHEMBL3265642 0.82 CKS1B (0.51)
SCHEMBL3265636 0.82 KDM4E (0.58) CHRM4CHRM2CHRM1
SCHEMBL3269094 0.81 CKS1B (0.47) CHRM4KCNH2
SCHEMBL30549291 0.81 PANK3 (0.53) CHRM4JAK2JAK3JAK1KCNH2
SCHEMBL2225824 0.81 PANK3 (0.53) CHRM4JAK2JAK3JAK1KCNH2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004207-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL-AND PIPERIDINYL-ALKYL CARBAMATES SANOFI-AVENTIS (FR) 2012-01-05 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-20120004207-A1 THERAPEUTIC USES OF DERIVATIVES OF PIPERIDINYL-AND PIPERIDINYL-ALKYL CARBAMATES CLCN2, CLIC1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 CHRM4 243/4885JAK2 2520/4885JAK3 3415/4885

“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.