SCHEMBL14192528

SCHEMBL14192528

C=CC(=O)Cc1ccc(-c2ccc(OC(=O)c3ccc(-c4ccc(OCC)cn4)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.64
THRB P10828 2/20 0.64
TP53 P04637 3/20 0.57
SMN1; SMN2 Q16637 5/20 0.54
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41
RXFP1 Q9HBX9 1/20 0.39
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL14192527 0.80 THRB (0.56) MAPTTHRBTP53SMN1; SMN2RAB9A
SCHEMBL14192520 0.80 THRB (0.58) MAPTTHRBTP53SMN1; SMN2RAB9A
SCHEMBL9722206 0.79 MAPT (0.58) MAPTTHRBTP53SMN1; SMN2NPC1
SCHEMBL9722476 0.79 MAPT (0.58) MAPTTHRBTP53SMN1; SMN2NPC1
SCHEMBL9722346 0.79 MAPT (0.58) MAPTTHRBTP53SMN1; SMN2NPC1
SCHEMBL9722429 0.79 MAPT (0.58) MAPTTHRBTP53SMN1; SMN2NPC1
SCHEMBL9722186 0.79 MAPT (0.58) MAPTTHRBTP53SMN1; SMN2NPC1
SCHEMBL9722412 0.79 MAPT (0.58) MAPTTHRBTP53SMN1; SMN2NPC1
SCHEMBL14192453 0.77 THRB (0.61) MAPTTHRBSMN1; SMN2KMT2A
SCHEMBL14192345 0.76 THRB (0.62) MAPTTHRBSMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7357964-B2 Liquid-crystalline vinyl ketone derivatives and their polymers CHISSO CORPORATION (JP) 2008-04-15 US disclosed