SCHEMBL12375081

SCHEMBL12375081

C=C(C)C(=O)Oc1ccc(OC(=O)CCc2ccc3cc(OC(=O)C(=C)C)ccc3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
LMNA P02545 2/20 0.52
CYP1A2 P05177 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
NPC1 O15118 1/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 1/20 0.52
MAOA P21397 1/20 0.52
SLC6A2 P23975 1/20 0.52
RAB9A P51151 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KMT2A Q03164 5/20 0.47
ELANE P08246 1/20 0.43
ATM Q13315 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40

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
SCHEMBL17433316 0.89 KMT2A (0.57) MAPTLMNAKMT2AELANEATM
SCHEMBL17719437 0.87 KMT2A (0.45) MAPTLMNACYP1A2SMN1; SMN2KDM4E
SCHEMBL17791338 0.86 ELANE (0.50) MAPTLMNACYP1A2SMN1; SMN2KDM4E
SCHEMBL18324427 0.85 THRB (0.42) MAPTLMNACYP1A2SMN1; SMN2KDM4E
SCHEMBL17433325 0.85 KMT2A (0.54) MAPTLMNAKMT2AELANEATM
SCHEMBL17719443 0.84 KMT2A (0.46) MAPTLMNACYP1A2SMN1; SMN2KDM4E
SCHEMBL20414523 0.83 KMT2A (0.47) MAPTLMNACYP1A2SMN1; SMN2KDM4E
SCHEMBL17754358 0.82 KMT2A (0.41) MAPTLMNACYP1A2SMN1; SMN2KDM4E
SCHEMBL1325036 0.81 ELANE (0.45) MAPTLMNACYP1A2SMN1; SMN2KDM4E
SCHEMBL12375045 0.81 MAPT (0.41) MAPTLMNACYP1A2SMN1; SMN2KDM4E

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
US-8440101-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-05-14 US disclosed
US-8440101-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-05-14 US disclosed
US-20110186776-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-08-04 US disclosed
US-20110186776-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-08-04 US disclosed