SCHEMBL6580060

SCHEMBL6580060

CC(C)(C)OC(=O)NC1CCN(C(C(=O)OCc2ccccc2)C2CCNCC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.47
CTSL P07711 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
NTSR1 P30989 1/20 0.46
ALDH1A1 P00352 2/20 0.45
CTSB P07858 1/20 0.45
CTSK P43235 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
DPP4 P27487 4/20 0.43
DPP7 Q9UHL4 4/20 0.43
KCNH2 Q12809 3/20 0.43
GAA P10253 1/20 0.43
SYK P43405 1/20 0.42
CKS1B P61024 1/20 0.42
SKP1 P63208 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
SCHEMBL6590305 0.87 KCNA3 (0.46) KCNA3L3MBTL1KMT2AALDH1A1CTSK
SCHEMBL6584371 0.80 CSNK1A1 (0.45) DPP4DPP7KCNH2CCR5
SCHEMBL6586301 0.79 CTSK (0.41) KCNA3CTSKCKS1BSKP1SKP2
SCHEMBL6584900 0.78 CTSK (0.46) KCNA3CTSKCKS1BSKP1SKP2
SCHEMBL7549641 0.78 KCNA3 (0.59) KCNA3L3MBTL1KMT2AMEN1POLB
SCHEMBL6588968 0.78 CTSK (0.45) KCNA3CTSKCKS1BSKP1SKP2
SCHEMBL951538 0.78 KMT2A (0.59) KCNA3L3MBTL1KMT2AMAPTMAPK1
SCHEMBL3944460 0.77 ALDH1A1 (0.69) CTSLL3MBTL1KMT2AALDH1A1CTSB
SCHEMBL3944464 0.77 ALDH1A1 (0.69) CTSLL3MBTL1KMT2AALDH1A1CTSB
SCHEMBL6153463 0.77 ALDH1A1 (0.69) CTSLL3MBTL1KMT2AALDH1A1CTSB

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-1076055-B1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS DAINIPPON PHARMACEUTICAL CO (JP) 2004-11-24 EP disclosed
EP-1362857-B1 (S)-4-amino-5-chloro-2-methoxy-N-[1-[1-(2-tetrahydrofuryl-carbonyl)-4-piperidinylmethyl]-4-piperidinyl]benzamide for treating gastrointestinal motility disorders DAINIPPON PHARMACEUTICAL CO (JP) 2004-08-11 EP disclosed
US-6696468-B2 GASTROINTESTINAL MOTILITY ENHANCER OR PROKINETIC AGENT; AFFINITY FOR 5-HT4 RECEPTOR; REDUCED SIDE EFFECTS TO HEART OR CENTRAL NERVOUS SYSTEM DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2004-02-24 US disclosed
US-20030216433-A1 (S)-4-amino-5-chloro-2-methoxy-N-[1-[1-(2-tetrahydrofuryl-carbonyl)-4-piperidinylmethyl]-4-piperidinyl]benzamide, process for the preparation thereof, pharmaceutical composition containing the same, and intermediate therefor DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2003-11-20 US disclosed
EP-1362857-A1 (S)-4-amino-5-chloro-2-methoxy-n-[1-[1-(2-tetrahydrofuryl-carbonyl)-4-piperidinymethyl]-4-piperidinyl]benzamide for treating gastrointestinal motility disorders Dainippon Pharmaceutical Co., Ltd. (JP) 2003-11-19 EP disclosed
US-6294555-B1 SEROTONIN HT3 RECEPTOR ANTAGONIST FOR GASTROINTESTINAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2001-09-25 US disclosed
EP-1076055-A1 1- (1-SUBSTITUTED-4-PIPERIDINYL)METHYL]-4-PIPERIDINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES OF THESE COMPOUNDS Dainippon Pharmaceutical Co., Ltd. (JP) 2001-02-14 EP 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-20030216433-A1 (S)-4-amino-5-chloro-2-methoxy-N-[1-[1-(2-tetrahydrofuryl-carbonyl)-4-piperidinylmethyl]-4-piperidinyl]benzamide, process for the preparation thereof, pharmaceutical composition containing the same, and intermediate therefor GIPR, MLNR, HTR5A KCNA3 889/4885CTSL 1065/4885L3MBTL1 4394/4885

“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.