SCHEMBL14192548

SCHEMBL14192548

C=CC(=O)c1ccc2cc(-c3ccc(OC(=O)C4CCC(CCCCC)CC4)cc3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
EGFR P00533 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
JAK1 P23458 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
THRA P10827 5/20 0.37
ELANE P08246 2/20 0.37

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
SCHEMBL14192403 0.92 THRB (0.44) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL14192321 0.89 THRB (0.47) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL14192424 0.86 THRB (0.44) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL14192385 0.85 ELANE (0.44) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL14192541 0.84 CYP2C9 (0.46) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL3620303 0.83 THRB (0.54) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL3620302 0.83 THRB (0.54) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL14192581 0.82 THRB (0.38) THRBKMT2AMEN1MAPTTHRA
SCHEMBL14192432 0.82 THRB (0.44) THRBKMT2AMEN1SMN1; SMN2TDP1
SCHEMBL14192531 0.82 THRB (0.37) THRBKMT2AMEN1MAPTTHRA

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