SCHEMBL14192558

SCHEMBL14192558

C=CC(=O)c1ccc2c(c1)Cc1cc(OC(=O)c3ccc(OCC)cc3)ccc1-2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
CCNC P24863 1/20 0.44
CDK8 P49336 1/20 0.44
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
SRD5A1 P18405 1/20 0.41
SRD5A2 P31213 1/20 0.41
NPC1 O15118 3/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
CSNK2A1 P68400 1/20 0.40
CSNK2A3 Q8NEV1 1/20 0.40
MAPT P10636 5/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 2/20 0.39
CES2 O00748 1/20 0.39
PARP10 Q53GL7 1/20 0.39
THRB P10828 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
SCHEMBL14192517 0.91 SRD5A1 (0.43) KMT2ACCNCCDK8SRD5A1SRD5A2
SCHEMBL14192584 0.88 SMN1; SMN2 (0.44) KMT2ANPC1MAPTLMNASMN1; SMN2
SCHEMBL14192538 0.85 NPC1 (0.41) KMT2ACCNCCDK8PDGFRBPDGFRA
SCHEMBL14192588 0.83 NPC1 (0.38) KMT2ASRD5A1SRD5A2NPC1MAPT
SCHEMBL14192491 0.81 ACACB (0.45) KMT2ANPC1CSNK2A2CSNK2BCSNK2A1
SCHEMBL14192490 0.81 LMNA (0.49) KMT2ANPC1MAPTMEN1LMNA
SCHEMBL14088441 0.80 NPC1 (0.54) KMT2ANPC1MAPTLMNATHRB
SCHEMBL14192599 0.80 MAPT (0.35) KMT2ASRD5A1SRD5A2NPC1MAPT
SCHEMBL14088491 0.79 THRB (0.37) KMT2ANPC1MAPTMEN1RAB9A
SCHEMBL14192580 0.79 CYP2C9 (0.40) KMT2ANPC1MAPTMEN1RAB9A

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