SCHEMBL14192467

SCHEMBL14192467

C=CC(=O)CCCOc1ccc2cc(OC(=O)C3CCC(CC)CC3)ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 1/20 0.40
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
PDE5A O76074 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
PTAFR P25105 1/20 0.37
CYP2C19 P33261 1/20 0.37
BLM P54132 1/20 0.37
PDE1A P54750 1/20 0.37
PDE1B Q01064 1/20 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
SCHEMBL12154243 0.82 L3MBTL1 (0.59) L3MBTL1KMT2AMEN1MAPTPDGFRB
SCHEMBL14192519 0.81 ITGB3 (0.38) MAPTBCHEGAACNR2
SCHEMBL14192498 0.80 L3MBTL1 (0.46) L3MBTL1KMT2AMEN1MAPTPDGFRB
SCHEMBL20274052 0.76 THRB (0.43) KMT2AALDH1A1CYP3A4HPGDTSHR
SCHEMBL24555329 0.76 KMT2A (0.41) KMT2AMEN1ALDH1A1HPGDF2
SCHEMBL18199239 0.74 THRB (0.41) KMT2AALDH1A1CYP3A4HPGDTSHR
SCHEMBL20045170 0.74 KMT2A (0.61) L3MBTL1KMT2AMEN1MAPTHPGD
SCHEMBL12154218 0.74 KMT2A (0.61) L3MBTL1KMT2AMEN1MAPTHPGD
SCHEMBL8216786 0.73 TP53 (0.50) TSHRNPC1SMN1; SMN2
SCHEMBL9617785 0.73 SMN1; SMN2 (0.46) KMT2AMAPTALDH1A1HPGDTSHR

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