SCHEMBL1729429

SCHEMBL1729429

CC(=O)c1ccc(N2CCC(CNC(=O)O)CC2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 8/20 0.51
SKP1 P63208 8/20 0.51
SKP2 Q13309 8/20 0.51
HRH3 Q9Y5N1 2/20 0.51
ALDH1A1 P00352 4/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
NPC1 O15118 3/20 0.50
TSHR P16473 2/20 0.50
MAPT P10636 2/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 2/20 0.46
PKM P14618 1/20 0.46
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
KDM1A O60341 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
CETP P11597 1/20 0.43

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
SCHEMBL1729621 0.86 CKS1B (0.51) CKS1BSKP1SKP2HRH3ALDH1A1
SCHEMBL19598739 0.83 HRH3 (0.54) HRH3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL3266247 0.82 HRH3 (0.46) CKS1BSKP1SKP2HRH3ALDH1A1
SCHEMBL1727740 0.82 CKS1B (0.47) CKS1BSKP1SKP2ALDH1A1RAB9A
SCHEMBL1727907 0.82 DEGS1 (0.56) CKS1BSKP1SKP2MAPTKDM4E
SCHEMBL19598748 0.81 HRH3 (0.52) HRH3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL1728812 0.81 CKS1B (0.56) CKS1BSKP1SKP2CETP
SCHEMBL10044278 0.80 HRH3 (0.51) HRH3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL1729285 0.80 CHRM4 (0.57) CETP
SCHEMBL1728740 0.80 LMNA (0.61) CKS1BSKP1SKP2ALDH1A1SMN1; SMN2

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
EP-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 EP claimed