SCHEMBL5784264

SCHEMBL5784264

CCn1nnc(-c2ccc(CC3CCCCN3C(=O)O)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
GAA P10253 2/20 0.51
TSHR P16473 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
DAGLA Q9Y4D2 11/20 0.48
ABHD6 Q9BV23 4/20 0.48
DAGLB Q8NCG7 6/20 0.48
ALDH1A1 P00352 2/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL3542189 0.76 GAA (0.56) LMNAGAATSHRNPSR1ALDH1A1
SCHEMBL4629395 0.74 HSD11B1 (0.61) DAGLAABHD6DAGLB
SCHEMBL4964339 0.74 HSD11B1 (0.61) DAGLAABHD6DAGLB
Hydrochloric Acid SCHEMBL29238125 0.73 HSD11B1 (0.60) DAGLAABHD6DAGLB
SCHEMBL23459127 0.70 SCD5 (0.57) DAGLAABHD6
SCHEMBL7709183 0.70 LMNA (0.63) LMNATSHRHPGDSMN1; SMN2
SCHEMBL908981 0.70 SCD5 (0.57) DAGLAABHD6
SCHEMBL30360947 0.69 HRH3 (0.54) GAADAGLAABHD6DAGLBALDH1A1
SCHEMBL5181319 0.68 PARP14 (0.44) GAADAGLAABHD6DAGLB
SCHEMBL27630774 0.67 NPC1 (0.64) DAGLAABHD6DAGLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572668-A4 N-(SUBSTITUTED ARYLMETHYL)-4-(DISUBSTITUTED METHYL)PIPERIDINES AND PIPERAZINES FMC CORP (US) 2006-12-06 EP disclosed
EP-1572207-A4 N-(SUBSTITUTED ARYLMETHYL)-4-(DISUBSTITUTED METHYL) PIPERIDINES AND PYRIDINES FMC CORP (US) 2006-11-29 EP disclosed
EP-1572207-A1 N-(SUBSTITUTED ARYLMETHYL)-4-(DISUBSTITUTED METHYL) PIPERIDINES AND PYRIDINES FMC CORPORATION (US) 2005-09-14 EP disclosed
EP-1572668-A2 N-(SUBSTITUTED ARYLMETHYL)-4-(DISUBSTITUTED METHYL)PIPERIDINES AND PIPERAZINES FMC CORPORATION (US) 2005-09-14 EP disclosed
WO-2004060865-A2 N-(SUBSTITUTED ARYLMETHYL)-4-(DISUBSTITUTED METHYL)PIPERIDINES AND PIPERAZINES FMC CORPORATION (US) 2004-07-22 WO disclosed
WO-2004060371-A1 N-(SUBSTITUTED ARYLMETHYL)-4-(DISUBSTITUTED METHYL) PIPERIDINES AND PYRIDINES FMC CORPORATION (US) 2004-07-22 WO disclosed