SCHEMBL1551850

SCHEMBL1551850

Clc1cc2ccccc2nc1OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.55
HTT P42858 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
STAT3 P40763 2/20 0.55
MAPT P10636 3/20 0.50
LMNA P02545 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HPGD P15428 1/20 0.50
PDE5A O76074 1/20 0.48
HRH4 Q9H3N8 4/20 0.45
ALOX5 P09917 1/20 0.45
CYP3A4 P08684 1/20 0.44
POLB P06746 1/20 0.43
PIN1 Q13526 1/20 0.43
PTGES O14684 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42
SQOR Q9Y6N5 1/20 0.40
ADORA3 P0DMS8 1/20 0.40

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
SCHEMBL28485531 0.81 L3MBTL1 (0.64) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL31574614 0.81 L3MBTL1 (0.55) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL30986715 0.81 L3MBTL1 (0.55) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL27493148 0.77 TLR8 (0.55) L3MBTL1HTTSMN1; SMN2MAPTLMNA
SCHEMBL27621425 0.77 HTT (0.68) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL4740388 0.77 ALDH1A1 (0.69) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL27906795 0.76 HRH4 (0.47) HTTSMN1; SMN2MAPTLMNAKDM4E
SCHEMBL4740384 0.75 L3MBTL1 (0.52) L3MBTL1HTTSMN1; SMN2STAT3MAPT
SCHEMBL12970296 0.74 TLR8 (0.49) SMN1; SMN2STAT3MAPTLMNAKDM4E
SCHEMBL17164561 0.74 L3MBTL1 (0.51) L3MBTL1HTTSMN1; SMN2STAT3MAPT

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-2313394-A1 NOVEL TETRAMETHYL SUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NeuroSearch A/S (DK) 2011-04-27 EP disclosed
WO-2009156396-A1 NOVEL TETRAMETHYL SUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2009-12-30 WO disclosed