SCHEMBL6586735

SCHEMBL6586735

CN(C)C(=O)N1CCC(CN2CCC(N)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.41
HSD17B10 Q99714 1/20 0.40
HTR4 Q13639 1/20 0.40
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL7839825 0.85 HTR1A (0.46) MAPTSMN1; SMN2KMT2AGNAI3GNAO1
SCHEMBL880655 0.85 KMT2A (0.53) MAPTSMN1; SMN2MEN1KMT2AGAA
Hydrochloric Acid SCHEMBL853922 0.83 KMT2A (0.51) MAPTSMN1; SMN2MEN1KMT2AGAA
SCHEMBL6584534 0.82 CXCR3 (0.45) MAPTSMN1; SMN2GAAHTR4GNAI3
SCHEMBL6584316 0.81 ACHE (0.35) MAPTSMN1; SMN2GAAGNAI3GNAO1
SCHEMBL6585178 0.80 SMN1; SMN2 (0.42) MAPTSMN1; SMN2GAADRD2GNAI3
SCHEMBL6586007 0.79 POLB (0.47) MAPTGAA
SCHEMBL6585893 0.78 HTR4 (0.43) MAPTGAAHTR4
SCHEMBL17284568 0.78 HSD17B10 (0.44) MAPTSMN1; SMN2MEN1KMT2AGAA
SCHEMBL6584309 0.78 SMN1; SMN2 (0.51) MAPTSMN1; SMN2GAA

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 3 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
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