SCHEMBL4524152

SCHEMBL4524152

Nc1cccnc1N1CCC(C(=O)O)CC1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NEK2 P51955 5/20 0.67
KDM4E B2RXH2 2/20 0.60
CYP2C19 P33261 1/20 0.60
MALT1 Q9UDY8 4/20 0.56
RECQL P46063 1/20 0.53
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
ELANE P08246 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
NOTUM Q6P988 1/20 0.45

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
SCHEMBL2080112 0.88 KDM4E (0.67) NEK2KDM4EMALT1RECQLKMT2A
SCHEMBL14335272 0.85 MALT1 (0.61) NEK2KDM4EMALT1RECQLKMT2A
SCHEMBL2421306 0.84 MALT1 (0.70) NEK2KDM4ECYP2C19MALT1KMT2A
SCHEMBL14334510 0.83 MALT1 (0.60) NEK2KDM4EMALT1RECQLKMT2A
SCHEMBL14334180 0.83 MALT1 (0.52) NEK2KDM4EMALT1RECQLKMT2A
SCHEMBL4533155 0.83 MALT1 (0.54) NEK2KDM4EMALT1RECQLKMT2A
SCHEMBL3104049 0.83 NEK2 (0.59) NEK2KDM4ECYP2C19MALT1RECQL
SCHEMBL238160 0.82 KDM4E (0.60) NEK2KDM4ECYP2C19MALT1RECQL
SCHEMBL4879872 0.82 KDM4E (0.60) NEK2KDM4ECYP2C19MALT1RECQL
SCHEMBL4697505 0.82 MALT1 (0.48) NEK2KDM4EMALT1RECQLKMT2A

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-7501440-B2 Substituted benzoylureidopyridylpiperidine-and-pyrrolidinecarboxylic acid derivatives, processes for preparing them and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-03-10 US disclosed
US-20040266768-A1 Substituted benzoylureidopyridylpiperidine-and-pyrrolidinecarboxylic acid derivatives, processes for preparing them and their use AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-12-30 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-20040266768-A1 Substituted benzoylureidopyridylpiperidine-and-pyrrolidinecarboxylic acid derivatives, processes for preparing them and their use SLC5A2, HPD, DPP4 NEK2 2324/4885KDM4E 1444/4885CYP2C19 99/4885

“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.