SCHEMBL2890304

SCHEMBL2890304

C=CC1CCC(C(O)CCC(=O)O)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
BLM P54132 1/20 0.39
SLC6A3 Q01959 1/20 0.39
MEN1 O00255 1/20 0.39
CYP2D6 P10635 1/20 0.39
NFKB1 P19838 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
TET2 Q6N021 3/20 0.35
KDM4A O75164 2/20 0.35
KDM4C Q9H3R0 2/20 0.35
KDM2A Q9Y2K7 2/20 0.35
TET3 O43151 1/20 0.35
MAPT P10636 2/20 0.32
ABCC4 O15439 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 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
SCHEMBL29954549 0.85 TET2 (0.46) TSHRTET2KDM4AKDM4CKDM2A
SCHEMBL2888407 0.79 L3MBTL1 (0.37) TSHRKMT2ALMNACYP1A2
Malonic Acid SCHEMBL15654125 0.71 LDHA (0.45) TSHRKMT2AMAPTABCC4HSD17B10
SCHEMBL9176186 0.71 TET2 (0.42) CYP2D6NFKB1TET2KDM4AKDM4C
SCHEMBL12617396 0.70 ACE (0.40) TSHRTET2KDM4AKDM4CKDM2A
Bicarbonate SCHEMBL9715828 0.70
SCHEMBL27995352 0.67 BLM (0.41) BLMKMT2AMAPTLMNACYP1A2
SCHEMBL12227361 0.66 ANPEP (0.43) KMT2AMAPTABCC4LMNAGABRA1
Acetic Acid SCHEMBL31249677 0.66
SCHEMBL27634689 0.64 MEN1 (0.46) TSHRSLC6A2SLC6A4BLMSLC6A3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2128149-B1 Tetrahydrofuran compound, liquid crystal composition and liquid crystal display device containing the liquid crystal composition JNC CORP (JP) 2013-07-24 EP disclosed
EP-1798228-B1 TETRAHYDROPYRAN COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAYS CONTAINING THE COMPOSITIONS JNC CORP (JP) 2012-11-14 EP disclosed
US-7842357-B2 Tetrahydropyran compound, liquid crystal, composition and liquid crystal display device containing the liquid crystal composition CHISSO CORPORATION (JP) 2010-11-30 US disclosed
EP-2128149-A1 Tetrahydrofuran compound, liquid crystal composition and liquid crystal display device containing the liquid crystal composition Chisso Corporation (JP) 2009-12-02 EP disclosed
EP-1798228-A1 TETRAHYDROPYRAN COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAYS CONTAINING THE COMPOSITIONS CHISSO CORPORATION (JP) 2007-06-20 EP disclosed
US-20060071194-A1 Tetrahydrofuran compound, liquid crystal, composition and liquid crystal display device containing the liquid crystal composition JNC PETROCHEMICAL CORPORATION (JP) 2006-04-06 US disclosed