SCHEMBL8044997

SCHEMBL8044997

CCCCCC1(c2ccccc2OCC)CCC(C(=O)O)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
GLA P06280 1/20 0.39
LMNA P02545 2/20 0.38
S1PR5 Q9H228 2/20 0.38
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
RXRA P19793 1/20 0.36
HNF4A P41235 1/20 0.36
PDE4B Q07343 1/20 0.36
KCNA3 P22001 2/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
S1PR1 P21453 1/20 0.35
FAAH O00519 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL8043547 0.96 L3MBTL1 (0.40) L3MBTL1GLALMNAS1PR5TSHR
SCHEMBL7511978 0.92 PDE4B (0.40) LMNAS1PR5PDE4BS1PR1FAAH
SCHEMBL8045475 0.92 GLA (0.41) L3MBTL1GLALMNATSHRSMN1; SMN2
SCHEMBL7514436 0.89 HTT (0.43) PDE4BKCNA3MEN1KMT2A
SCHEMBL7507058 0.87 PDE4B (0.41) L3MBTL1GLALMNAS1PR5TSHR
SCHEMBL10790633 0.82 PDE4B (0.38) LMNAS1PR5TSHRPDE4BS1PR1
SCHEMBL7511121 0.82 HSD11B1 (0.39) S1PR5S1PR1MEN1KMT2APOLB
SCHEMBL8725831 0.81 CYSLTR2 (0.43) S1PR5S1PR1
SCHEMBL7507861 0.81 S1PR1 (0.38) S1PR5S1PR1MEN1KMT2APOLB
SCHEMBL8078671 0.81 TSHR (0.41) L3MBTL1GLALMNAS1PR5TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805134-B1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORP (JP) 2000-08-30 EP disclosed
US-6086964-A Liquid crystalline compound having dienyl moiety and liquid crystal composition CHISSO CORPORATION (JP) 2000-07-11 US disclosed
EP-0733692-B1 Liquid crystalline compound, liquid crystal composition containing the same, and display device CHISSO CORP (JP) 2000-06-14 EP disclosed
US-6001275-A LIQUID CRYSTALLINE COMPOUND WHICH HAS A LARGE RATIO OF ELASTIC CONSTANTS, HAS A LOW VISCOSITY, EXCELLENT MISCIBILITY WITH OTHER LIQUID CRYSTALLINE COMPOUND, CHEMICALLY STABLE; HAVING AN UNCONJUGATED ALKADIENYL GROUP AT A SIDE CHAIN. CHISSO CORPORATION (JP) 1999-12-14 US disclosed
US-5833879-A LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES CHISSO CORPORATION (JP) 1998-11-10 US disclosed
US-5714088-A TRIFLUOROMETHYL- OR -METHOXYPHENYL-SUBSTITUTED BRANCHED ALKYL-SUBSTITUTED CYCLOHEXANES; LARGE POSITIVE VALUE OF DIELECTRIC ANISOTROPY; VERY LOW VISCOSITY; HIGH VOLTAGE HOLDING RATIO(SPECIFIC RESISTANCE); UV STABILITY CHISSO CORPORATION (JP) 1998-02-03 US disclosed
EP-0805134-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-11-05 EP disclosed