SCHEMBL9560694

SCHEMBL9560694

CC(c1ccc(F)cc1)C(CCN1CCCCC1)COCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
SLC6A4 P31645 4/20 0.43
SLC6A3 Q01959 4/20 0.43
SCN5A Q14524 1/20 0.42
ACHE P22303 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
SLC6A2 P23975 2/20 0.41
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL7414312 0.81 PSEN1 (0.41) SLC6A4SLC6A3SCN5AACHE
SCHEMBL10431044 0.77 ACHE (0.50) SLC6A4SLC6A3SCN5AACHELMNA
SCHEMBL7413899 0.77 MME (0.41) SLC6A3MEN1KMT2AALDH1A1TSHR
SCHEMBL5080329 0.77 HTR1A (0.46) SLC6A4SCN5AACHESLC6A2CYP1A2
SCHEMBL18723710 0.76 LTA4H (0.52) LTA4HALDH1A1LMNASMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL10644448 0.72 HRH3 (0.48) SMN1; SMN2
SCHEMBL4212610 0.69 MEN1 (0.44) MEN1KMT2AALDH1A1MAPTTSHR
SCHEMBL6393260 0.68 LTA4H (0.84) LTA4HSLC6A3ALDH1A1LMNASMN1; SMN2
SCHEMBL11487151 0.68 ACHE (0.54) SCN5AACHE
SCHEMBL11494698 0.68 ACHE (0.54) SCN5AACHE

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-0558487-A1 PIPERIDINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-09-08 EP disclosed