SCHEMBL14192532

SCHEMBL14192532

C=CC(=O)c1ccc2cc(OC(=O)c3ccc(-c4ccc(CCCC)cc4)cc3)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 10/20 0.59
THRA P10827 5/20 0.59
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
RARB P10826 6/20 0.47
MAPT P10636 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
EGFR P00533 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
JAK1 P23458 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 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
SCHEMBL14192571 0.89 THRB (0.50) THRBTHRAMEN1KMT2ARARB
SCHEMBL14192438 0.86 THRB (0.71) THRBTHRAMEN1KMT2ARARB
SCHEMBL14192492 0.86 KMT2A (0.51) THRBTHRAMEN1KMT2AMAPT
SCHEMBL4578912 0.85 THRB (0.71) THRBTHRAMEN1KMT2ARARB
SCHEMBL14192539 0.83 THRB (0.70) THRBTHRAMEN1KMT2ARARB
SCHEMBL14192573 0.83 THRB (0.60) THRBTHRAMEN1KMT2ARARB
SCHEMBL4578159 0.82 THRB (0.76) THRBTHRAMEN1KMT2AMAPT
SCHEMBL14192452 0.82 THRB (0.68) THRBTHRAMEN1KMT2ARARB
SCHEMBL14192518 0.82 THRB (0.68) THRBTHRAMEN1KMT2ARARB
SCHEMBL3618792 0.82 THRB (0.76) THRBTHRAMEN1KMT2ARARB

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