SCHEMBL8069413

SCHEMBL8069413

CCc1ccc(-c2cc(OC)ccc2C(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.59
MAPT P10636 4/20 0.52
TP53 P04637 2/20 0.52
LMNA P02545 1/20 0.52
KDM4E B2RXH2 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
LTB4R2 Q9NPC1 2/20 0.47
LTB4R Q15722 1/20 0.47
RAB9A P51151 2/20 0.47
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.45
FFAR1 O14842 1/20 0.45
CYP2C8 P10632 1/20 0.45
AKR1C3 P42330 4/20 0.44
AKR1C2 P52895 4/20 0.44
USP2 O75604 1/20 0.44

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
SCHEMBL7591657 0.88 SMN1; SMN2 (0.75) SMN1; SMN2MAPTKDM4ECYP1A2CYP2D6
SCHEMBL11543260 0.86 EIF4A1 (0.55) SMN1; SMN2LTB4R2FFAR1AKR1C2LPAR1
SCHEMBL4911849 0.85 PPARA (0.59) SMN1; SMN2MAPTLTB4R2ALDH1A1LPAR1
SCHEMBL9511283 0.85 LTB4R (0.53) SMN1; SMN2KDM4ELTB4R2LTB4RRAB9A
SCHEMBL20594609 0.84 RAB9A (0.54) SMN1; SMN2LTB4R2RAB9AALDH1A1
SCHEMBL9514041 0.83 PTGER4 (0.46) SMN1; SMN2MAPTTP53LMNARAB9A
SCHEMBL8566031 0.83 SMN1; SMN2 (0.64) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL9151080 0.83 SMN1; SMN2 (0.64) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL9683222 0.83 SMN1; SMN2 (0.64) SMN1; SMN2MAPTLMNAKDM4ECYP1A2
SCHEMBL6701301 0.83 SMN1; SMN2 (0.63) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6

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 4 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-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
EP-0805134-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-11-05 EP disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed