SCHEMBL13527672

SCHEMBL13527672

COc1ccc(Oc2ccc(C(=O)Oc3ccc(C)c(C)c3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.57
▸ MAPT P10636 5/20 0.57
▸ CYP1A2 P05177 2/20 0.57
▸ CYP2C9 P11712 2/20 0.57
▸ CYP2C19 P33261 2/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ PARP10 Q53GL7 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ GBA1 P04062 1/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ GFER P55789 1/20 0.49

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
SCHEMBL13913170 0.95 KMT2A (0.61) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL21081614 0.83 KMT2A (0.65) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL13527667 0.83 KMT2A (0.65) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL13527668 0.83 KMT2A (0.61) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL13539007 0.83 KMT2A (0.69) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL10042169 0.83 KMT2A (0.61) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL19630948 0.83 NR1H4 (0.54) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL14139886 0.82 KMT2A (0.55) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL15290365 0.82 SMN1; SMN2 (0.56) KMT2AMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL26039979 0.81 PRSS1 (0.52) KMT2AMAPTCYP1A2CYP2C9CYP2C19

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-7649077-B2 copolymer contains pyrimidines group monomer and fluorenes group monomer; color purity; good solubility characteristics and high glass transition temperatures; use as coatings and films that are relatively thin, thermally stable, and free of defects CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-01-19 — — US disclosed
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