SCHEMBL27983000

SCHEMBL27983000

CC=CC(=O)OCCOc1ccc(C(C)(C)c2ccc(OC(=O)C=CC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.44
POLB P06746 2/20 0.44
ALDH1A1 P00352 8/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 5/20 0.42
THRB P10828 1/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
PSMB1 P20618 1/20 0.39
PSMB5 P28074 1/20 0.39
PSMB2 P49721 1/20 0.39
MAPT P10636 1/20 0.38
AR P10275 1/20 0.38

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
SCHEMBL6231966 0.96 KDM4E (0.47) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL22472167 0.92 KDM4E (0.44) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL27888801 0.91 KDM4E (0.55) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL2059936 0.89 KDM4E (0.48) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL25269989 0.88 KDM4E (0.47) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL8735250 0.85 MAPT (0.41) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL13893348 0.83 KDM4E (0.48) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL20394042 0.82 THRB (0.60) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL28022616 0.82 POLB (0.35) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL4625648 0.80 HTT (0.47) KDM4EPOLBALDH1A1MEN1KMT2A

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
CN-104069010-A A dental material set and a dental membrane for obscuring a metal color of a dental metal, and a preparing method thereof SHOFU KK 2014-10-01 CN disclosed