SCHEMBL25063276

SCHEMBL25063276

COc1ccc(CN2C(=O)c3ccc4c5ccc6c7c(ccc(c8ccc(c3c48)C2=O)c75)C(=O)N(Cc2ccc(C=O)cc2)C6=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.57
▸ CASP3 P42574 2/20 0.52
▸ CMA1 P23946 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.47
▸ CYP2A6 P11509 1/20 0.47
▸ GSK3A P49840 1/20 0.47
▸ GSK3B P49841 1/20 0.47
▸ EP300 Q09472 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ APAF1 O14727 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SENP8 Q96LD8 1/20 0.45
▸ SENP7 Q9BQF6 1/20 0.45
▸ SENP6 Q9GZR1 1/20 0.45
▸ CLTC Q00610 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ HDAC3 O15379 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 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
SCHEMBL29392718 0.91 KDM4E (0.68) KDM4ECASP3CMA1GSK3AGSK3B
SCHEMBL30530601 0.91 KDM4E (0.68) KDM4ECASP3CMA1GSK3AGSK3B
SCHEMBL4651851 0.91 KDM4E (0.68) KDM4ECASP3CMA1GSK3AGSK3B
SCHEMBL24414744 0.86 KDM4E (0.61) KDM4ECASP3CMA1GSK3AGSK3B
SCHEMBL15773124 0.85 KDM4E (0.75) KDM4ECASP3CMA1ALDH1A1GSK3A
SCHEMBL4653005 0.78 KDM4E (0.50) KDM4ECASP3ALDH1A1MEN1KMT2A
SCHEMBL15858007 0.77 KDM4E (0.54) KDM4ECASP3CMA1ALDH1A1GSK3A
SCHEMBL15858006 0.77 KDM4E (0.51) KDM4ECASP3CMA1ALDH1A1GSK3A
SCHEMBL15858011 0.76 KDM4E (0.50) KDM4ECASP3CMA1ALDH1A1GSK3A
SCHEMBL8680697 0.75 KDM4E (0.63) KDM4ECASP3CMA1ALDH1A1MEN1

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-20230053492-A1 RESIN COMPOSITION, FILM, OPTICAL FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-02-23 — — US disclosed
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