SCHEMBL19624192

SCHEMBL19624192

C=CC(=O)OCC(COc1ccc(C(=O)Oc2ccc(OCC)cc2)cc1)OC(=O)C=C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.44
CCNC P24863 1/20 0.44
CDK8 P49336 1/20 0.44
LMNA P02545 2/20 0.43
MAPT P10636 3/20 0.42
THRB P10828 2/20 0.42
ALDH1A1 P00352 3/20 0.41
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PARP10 Q53GL7 1/20 0.40
NPC1 O15118 2/20 0.39
PRSS1 P07477 2/20 0.39
ACR P10323 2/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL13865600 0.95 KMT2A (0.40) KMT2AGAACCNCCDK8LMNA
SCHEMBL13865602 0.95 KMT2A (0.40) KMT2AGAACCNCCDK8LMNA
SCHEMBL17933431 0.92 KMT2A (0.46) KMT2AGAALMNAMAPTALDH1A1
SCHEMBL19759252 0.91 KMT2A (0.38) KMT2AGAACCNCCDK8LMNA
SCHEMBL13865592 0.90 THRB (0.43) KMT2AGAACCNCCDK8MAPT
SCHEMBL17933446 0.90 KMT2A (0.37) KMT2AGAACCNCCDK8LMNA
SCHEMBL13865577 0.89 NPC1 (0.53) KMT2ALMNAMAPTTHRBALDH1A1
SCHEMBL17933629 0.86 THRB (0.50) KMT2ALMNAMAPTTHRBALDH1A1
SCHEMBL1531824 0.86 NPC1 (0.41) KMT2AGAALMNAMAPTTHRB
SCHEMBL13865610 0.85 PPARD (0.36) KMT2AGAACCNCCDK8LMNA

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
EP-3246340-B1 POLYMERIZABLE COMPOSITION AND OPTICALLY ANISOTROPIC BODY USING SAME DAINIPPON INK & CHEMICALS (JP) 2019-10-09 EP disclosed
EP-3246340-A1 POLYMERIZABLE COMPOSITION AND OPTICALLY ANISOTROPIC BODY USING SAME DIC Corporation (JP) 2017-11-22 EP disclosed