SCHEMBL7954897

SCHEMBL7954897

CN(C)CCOc1ccccc1-c1noc(-c2ccccc2OCCN(C)C)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.56
NPSR1 Q6W5P4 2/20 0.52
TTR P02766 1/20 0.52
KDM4E B2RXH2 7/20 0.51
HSD17B10 Q99714 5/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 3/20 0.51
TSHR P16473 2/20 0.51
HPGD P15428 2/20 0.51
USP2 O75604 1/20 0.51
CASP1 P29466 1/20 0.51
SMN1; SMN2 Q16637 10/20 0.50
NPC1 O15118 7/20 0.50
RAB9A P51151 7/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 5/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HTR1B P28222 1/20 0.49
GAA P10253 2/20 0.48
PKM P14618 1/20 0.48

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
SCHEMBL7956815 0.95 HTR7 (0.66) HTR7NPSR1KDM4EHSD17B10ALDH1A1
SCHEMBL7964562 0.94 NPC1 (0.51) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7947650 0.92 SMN1; SMN2 (0.52) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7960663 0.92 SMN1; SMN2 (0.52) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7962019 0.92 NPC1 (0.56) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7958835 0.91 HTR7 (0.50) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7947807 0.91 HTR7 (0.56) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7957242 0.91 SMN1; SMN2 (0.50) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7957127 0.91 CASP3 (0.57) HTR7NPSR1TTRKDM4EHSD17B10
SCHEMBL7961683 0.91 CASP3 (0.51) HTR7NPSR1TTRKDM4EHSD17B10

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
US-6277872-B1 ANTIISCHEMIC AGENTS; BRAIN DISORDERS BOEHRINGER INGELHEIM KG (DE) 2001-08-21 US disclosed