SCHEMBL12415575

SCHEMBL12415575

COC(=O)c1ccccc1NC1CCN(C)CC1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.55
ALDH1A1 P00352 10/20 0.55
HPGD P15428 3/20 0.55
POLB P06746 2/20 0.51
ATM Q13315 1/20 0.51
HSD17B10 Q99714 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALOX12 P18054 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MAPT P10636 2/20 0.50
TSHR P16473 2/20 0.48
MAPK10 P53779 2/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 2/20 0.48
ALOX15 P16050 1/20 0.48
CHEK1 O14757 1/20 0.47
CHEK2 O96017 1/20 0.47
GAA P10253 2/20 0.47

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
SCHEMBL3512849 0.87 ADRA1A (0.44) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL3642902 0.85 GAA (0.50) KDM4EALDH1A1HPGDPOLBHSD17B10
SCHEMBL10371031 0.85 CDK1 (0.43) KDM4EPOLBLMNA
SCHEMBL16599217 0.85 KDM4E (0.65) KDM4EALDH1A1HPGDPOLBATM
SCHEMBL27807019 0.84 SSTR4 (0.42) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL22605677 0.84 JAK2 (0.50) KDM4EALDH1A1CHEK1
SCHEMBL19335455 0.84 KDM4E (0.70) KDM4EALDH1A1HPGDPOLBATM
SCHEMBL18594835 0.84 KDM4E (0.70) KDM4EALDH1A1HPGDPOLBATM
SCHEMBL7065164 0.84 KDM4E (0.70) KDM4EALDH1A1HPGDPOLBATM
SCHEMBL9855953 0.82 CDK1 (0.41) POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110172270-A1 2-'4(PHENYLAMINO)-PIPERIDIN-1-YL!-N-PHENYL-ACETAMINE DERIVATIVES AND RELATED COMPOUNDS AS NEUROPEPTIDE Y5 (NPY5) LIGANDS FOR THE TREATMENT OF OBESITY LABORATORIOS DEL DR. ESTEVE S.A (ES) 2011-07-14 US disclosed
US-20110172270-A1 2-'4(PHENYLAMINO)-PIPERIDIN-1-YL!-N-PHENYL-ACETAMINE DERIVATIVES AND RELATED COMPOUNDS AS NEUROPEPTIDE Y5 (NPY5) LIGANDS FOR THE TREATMENT OF OBESITY LABORATORIOS DEL DR. ESTEVE S.A (ES) 2011-07-14 US disclosed
US-7888510-B2 1,4-disubstituted piperidine compounds like N-(9-Ethyl-9H-carbazol-3-yl)-2-[4-(2-hydroxymethyl-6-methyl-phenylamino)-piperidine-yl]acetamide; chloroacetyl chloride is reacted with respective compounds in the presence of dichloromethane and triethylamine or diisopropylethylamine LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2011-02-15 US disclosed
US-7888510-B2 1,4-disubstituted piperidine compounds like N-(9-Ethyl-9H-carbazol-3-yl)-2-[4-(2-hydroxymethyl-6-methyl-phenylamino)-piperidine-yl]acetamide; chloroacetyl chloride is reacted with respective compounds in the presence of dichloromethane and triethylamine or diisopropylethylamine LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2011-02-15 US disclosed
EP-1660131-B1 ACTIVE SUBSTANCE COMBINATION COMPRISING A COMPOUND WITH NPY RECEPTOR AFFINITY AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY ESTEVE LABOR DR (ES) 2009-06-24 EP disclosed
US-20080119516-A1 2-'4(Phenylamino)-Piperidin-1-Yl!-N-Phenyl-Acetamine Derivatives and Related Compounds as Neuropeptide Y5 (NPY5) Ligands for the Treatment of Obesity LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2008-05-22 US disclosed
US-20080119516-A1 2-'4(Phenylamino)-Piperidin-1-Yl!-N-Phenyl-Acetamine Derivatives and Related Compounds as Neuropeptide Y5 (NPY5) Ligands for the Treatment of Obesity LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2008-05-22 US disclosed
US-20070009597-A1 Active substance combination comprising a compound with npy receptor affinity and a compound with 5-ht6 receptor affinity LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-01-11 US disclosed
US-20070009597-A1 Active substance combination comprising a compound with npy receptor affinity and a compound with 5-ht6 receptor affinity LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-01-11 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 (3 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-20080119516-A1 2-'4(Phenylamino)-Piperidin-1-Yl!-N-Phenyl-Acetamine Derivatives and Related Compounds as Neuropeptide Y5 (NPY5) Ligands for the Treatment of Obesity NPY5R, NPY1R, NPY4R KDM4E 1204/4885ALDH1A1 2876/4885HPGD 2661/4885
US-20070009597-A1 Active substance combination comprising a compound with npy receptor affinity and a compound with 5-ht6 receptor affinity NPY5R, HTR6, NPY2R KDM4E 3574/4885ALDH1A1 3880/4885HPGD 1771/4885
US-20110172270-A1 2-'4(PHENYLAMINO)-PIPERIDIN-1-YL!-N-PHENYL-ACETAMINE DERIVATIVES AND RELATED COMPOUNDS AS NEUROPEPTIDE Y5 (NPY5) LIGANDS FOR THE TREATMENT OF OBESITY NPY5R, NPY1R, NPY4R KDM4E 1242/4885ALDH1A1 3299/4885HPGD 2808/4885

“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.