SCHEMBL11144665

SCHEMBL11144665

COc1cccc(N2CCC(NC(C)=O)CC2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.54
ACACB O00763 3/20 0.53
CKS1B P61024 1/20 0.53
SKP1 P63208 1/20 0.53
SKP2 Q13309 1/20 0.53
HTR1A P08908 2/20 0.47
HTR2A P28223 2/20 0.47
DRD3 P35462 2/20 0.47
HSD11B1 P28845 2/20 0.46
PDCD1LG2 Q9BQ51 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
HTR2C P28335 1/20 0.44
SMO Q99835 1/20 0.43
LCAT P04180 1/20 0.43
SUV39H2 Q9H5I1 1/20 0.43
C5AR1 P21730 1/20 0.43
SMPD3 Q9NY59 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 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
SCHEMBL11152923 0.84 CKS1B (0.55) ACACBCKS1BSKP1SKP2HSD11B1
SCHEMBL11148822 0.84 CKS1B (0.57) ACACBCKS1BSKP1SKP2HTR1A
SCHEMBL16769730 0.83 HRH3 (0.57) HRH3ACACBHTR1AHTR2ADRD3
SCHEMBL11148907 0.83 CKS1B (0.49) ACACBCKS1BSKP1SKP2HTR1A
SCHEMBL11148903 0.82 HTR3E (0.57) CKS1BSKP1SKP2HSD11B1PDCD1LG2
SCHEMBL13865726 0.78 KDM4E (0.44) HRH3ALDH1A1HPGDTSHRHSD17B10
SCHEMBL3282708 0.78 HRH3 (0.43) HRH3ACACBHTR1AHTR2ADRD3
SCHEMBL3826847 0.76 HTR3E (0.60) HRH3ACACBCKS1BSKP1SKP2
SCHEMBL25233477 0.76 CKS1B (0.47) ACACBCKS1BSKP1SKP2CD274
SCHEMBL2301058 0.76 CKS1B (0.60) HRH3CKS1BSKP1SKP2SMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4409228-A ANOREXIGENIC AGENTS SANOFI (FR) 1983-10-11 US disclosed
EP-0045980-B1 COMPOUNDS USEFUL IN THE PREPARATION OF AMINOPIPERIDINES WITH ANORECTIC PROPERTIES SANOFI S.A. (FR) 1983-10-05 EP disclosed
EP-0021973-B1 ANORECTIC AMINO PIPERIDINES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM SANOFI S.A. (FR) 1982-12-08 EP disclosed
EP-0045980-A1 Compounds useful in the preparation of aminopiperidines with anorectic properties SANOFI S.A. (FR) 1982-02-17 EP disclosed
EP-0021973-A2 Anorectic amino piperidines, process for their preparation and medicaments containing them SANOFI S.A. (FR) 1981-01-07 EP disclosed