SCHEMBL7546938

SCHEMBL7546938

C[N+](C)(C)C1CCCCC1.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA10 Q9GZZ6 1/20 0.35
CHRNA9 Q9UGM1 1/20 0.35
HPGD P15428 2/20 0.33
PKM P14618 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SLC18A3 Q16572 2/20 0.30
POLB P06746 1/20 0.30
CASP3 P42574 1/20 0.30

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
SCHEMBL7548952 0.80 PKM (0.37) CHRNA7CHRNB4CHRNA3CHRNA10CHRNA9
SCHEMBL4389309 0.75 EPHX2 (0.35) HPGDMEN1KMT2AKDM4EALDH1A1
Tetramethylammonium Ion SCHEMBL465007 0.73 APOBEC3A (0.41) KDM4EALDH1A1MAPTRAB9ANPSR1
SCHEMBL26757190 0.73 ALDH1A1 (0.30) ALDH1A1
SCHEMBL25522980 0.73 ALDH1A1 (0.30) ALDH1A1
SCHEMBL11476043 0.73 ALDH1A1 (0.30) ALDH1A1
SCHEMBL670819 0.73 ALDH1A1 (0.30) ALDH1A1
SCHEMBL699322 0.72 HPGD (0.32) HPGDMEN1KMT2AKDM4EALDH1A1
SCHEMBL137309 0.72 LMNA (0.34) HPGDPKMMEN1KMT2AKDM4E
Tetramethylammonium Ion SCHEMBL9468268 0.71 APOBEC3A (0.39) KDM4EALDH1A1MAPTNPSR1

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-0667366-B1 Process for the production of aromatic polycarbonate TEIJIN LTD (JP) 2002-06-26 EP disclosed
US-5516878-A CATALYTIC ESTER INTERCHANGE USING AN ALKALI METAL SALT OF AN ATE-COMPLEX OF A METAL SELECTED FROM SILICON, GERMANIUM, TIN, OR LEAD TEIJIN LIMITED (JP) 1996-05-14 US disclosed
EP-0667366-A2 Process for the production of aromatic polycarbonate TEIJIN LIMITED (JP) 1995-08-16 EP disclosed