SCHEMBL14930447

SCHEMBL14930447

COC(=O)/C=C/c1ccc2ccccc2c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 1/20 0.43
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP1A1 P04798 3/20 0.43
CYP1B1 Q16678 3/20 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
SCHEMBL23606857 0.85 KMT2A (0.49) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL14930449 0.84 L3MBTL1 (0.52) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL14930448 0.82 CYP1A1 (0.52) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL14930451 0.82 SMN1; SMN2 (0.47) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL7394712 0.82 MAOB (0.59) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL7394709 0.82 MAOB (0.59) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL14926741 0.82 ALDH1A1 (0.43) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL5292811 0.81 HDAC8 (0.64) KDM4EKMT2ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL27533541 0.79 ALDH1A1 (0.49) KDM4EKMT2ASMN1; SMN2CCNCCDK8
SCHEMBL3165097 0.78 NCEH1 (0.51) KDM4EKMT2ASMN1; SMN2CCNCCDK8

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-20130116396-A1 POLYMER FOR USE IN LIQUID CRYSTAL ALIGNMENT LAYER DIC CORPORATION (JP) 2013-05-09 US disclosed