SCHEMBL4526359

SCHEMBL4526359

OCC#CCCCCCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
PTPN7 P35236 3/20 0.33
MIF P14174 1/20 0.33
HMGCR P04035 1/20 0.33
GPR84 Q9NQS5 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4534685 0.97
1,4-Butanediol SCHEMBL29204131 0.91 ALDH1A1 (0.33) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL8029318 0.91 ALDH1A1 (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL11674706 0.91 ALDH1A1 (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL7033691 0.91 ALDH1A1 (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL20597518 0.91 ALDH1A1 (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL4528983 0.88
SCHEMBL9146192 0.87 RAB9A (0.36) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL10945268 0.87 ALDH1A1 (0.41) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL28747752 0.85 LMNA (0.38) LMNAALDH1A1HSD17B10MEN1KMT2A

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
US-7619125-B2 Hydrogenation promoter, hydrogenation catalyst, and process for producing alkene compound KANTO KAGAKU KABUSHIKI KAISHA (JP) 2009-11-17 US disclosed
US-20080033221-A1 Hydrogenation Promoter, Hydrogenation Catalyst, and Process for Producing Alkene Compound NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) 2008-02-07 US disclosed