SCHEMBL8718023

SCHEMBL8718023

CC1(C(=O)O)CNCCC1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
KDM1A O60341 4/20 0.41
MAOA P21397 4/20 0.41
MAOB P27338 4/20 0.41
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
JAK3 P52333 1/20 0.35
USP2 O75604 1/20 0.35
SSTR4 P31391 1/20 0.34

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
SCHEMBL17948228 0.78 SLC18A3 (0.48) SLC18A3SIGMAR1KDM1AMAOAMAOB
SCHEMBL317325 0.77 TRPA1 (0.46) SLC18A3KDM1AMAOAMAOBMAPK1
SCHEMBL14045495 0.75 KDM1A (0.53) KDM1AMAOAMAOBMAPK1CYP2C19
SCHEMBL13556691 0.75 KDM1A (0.53) KDM1AMAOAMAOBMAPK1CYP2C19
SCHEMBL15766923 0.75 KDM1A (0.53) KDM1AMAOAMAOBMAPK1CYP2C19
SCHEMBL15541000 0.75 KDM1A (0.53) KDM1AMAOAMAOBMAPK1CYP2C19
SCHEMBL3530324 0.75 KDM1A (0.53) KDM1AMAOAMAOBMAPK1CYP2C19
SCHEMBL5009519 0.75 KDM1A (0.42) SLC18A3SIGMAR1KDM1AMAOAMAOB
SCHEMBL23646349 0.70 KDM1A (0.40) KDM1AMAOAMAOBMAPK1CYP2C19
SCHEMBL27658364 0.70 SLC18A3 (0.38) SLC18A3SIGMAR1KDM1AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828735-A1 PROCESS FOR PREPARING 4-ARYL-PIPERIDINE DERIVATIVES NOVO NORDISK A/S (DK) 1998-03-18 EP disclosed
WO-1996036636-A1 PROCESS FOR PREPARING 4-ARYL-PIPERIDINE DERIVATIVES NOVO NORDISK A/S (DK) 1996-11-21 WO disclosed