SCHEMBL7907372

SCHEMBL7907372

C=C(C)C(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc3c(C(F)(F)F)cc(=O)oc3c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.54
PPARA Q07869 2/20 0.53
AGER Q15109 2/20 0.50
HTT P42858 2/20 0.49
POLB P06746 1/20 0.49
APEX1 P27695 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 2/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
NPBWR1 P48145 1/20 0.44
MAOB P27338 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL7920960 0.91 AGER (0.60) ARPPARAAGERKDM4EALDH1A1
SCHEMBL7907388 0.87 ALDH1A1 (0.60) ARHTTPOLBAPEX1TDP1
SCHEMBL8835405 0.85 AR (0.54) ARPPARAAGERHTTKDM4E
SCHEMBL7914253 0.85 AGER (0.62) ARPPARAAGERMAOB
SCHEMBL5831209 0.82 KMT2A (0.59) HTTPOLBAPEX1TDP1KDM4E
SCHEMBL7914299 0.82 KMT2A (0.59) HTTPOLBAPEX1TDP1KDM4E
SCHEMBL7914273 0.81 KMT2A (0.60) HTTPOLBAPEX1TDP1KDM4E
SCHEMBL7914329 0.81 AGER (0.60) ARAGERKDM4EALDH1A1KMT2A
SCHEMBL7914259 0.80 AR (0.54) ARPPARAAGERKDM4EALDH1A1
SCHEMBL7917907 0.80 KMT2A (0.60) HTTPOLBAPEX1TDP1KDM4E

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-6201087-B1 POLYMERS WHICH CONTAIN COUMARIN OR QUINOLINONE DERIVATIVES AS PHOTOREACTIVE UNITS AS ORIENTING LAYERS FOR LIQUID CRYSTALS; PHOTOCHEMICAL STABILITY AND IMPROVED CONTRAST ROLIC AG (CH) 2001-03-13 US disclosed
EP-0783537-B1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS ROLIC AG (CH) 1999-12-01 EP disclosed