SCHEMBL4553693

SCHEMBL4553693

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(O)[C@H]2O[C@@H](n3cnc4c(=O)[nH]c(NC(=O)C(C)C)nc43)C[C@@H]2OC(=O)CCC(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.37
TYMP P19971 2/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
POLA1 P09884 1/20 0.34
TAAR1 Q96RJ0 2/20 0.34
HPGD P15428 1/20 0.33
PDE9A O76083 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31

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
SCHEMBL2113125 0.89 KDM4E (0.49) KDM4EALDH1A1TYMPTAS1R3TAS1R1
SCHEMBL7534659 0.89 KDM4E (0.49) KDM4EALDH1A1TYMPTAS1R3TAS1R1
SCHEMBL10490993 0.88 HPGD (0.44) TYMPTAS1R3TAS1R1TAAR1HPGD
SCHEMBL5133061 0.88 KDM4E (0.53) KDM4EALDH1A1TYMPTAS1R3TAS1R1
SCHEMBL11130624 0.86 KDM4E (0.48) KDM4EALDH1A1TYMPTAS1R3TAS1R1
SCHEMBL11281236 0.84 KDM4E (0.46) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL17222397 0.83 KDM4E (0.47) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL441421 0.83 TYMP (0.48) KDM4ETYMPTAS1R3TAS1R1TAAR1
SCHEMBL6841553 0.82 KDM4E (0.46) KDM4EALDH1A1TYMPTAS1R3TAS1R1
SCHEMBL4434106 0.82 ADORA2A (0.39)

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080125327-A1 Bonding amino moieties to solid surface with reactive hydroxyl groups, bonding succinate moieties to the amine groups through amide bonds to form cleavable linkers attached to the solid surface, bonding a succinate group, a sugar group and a base group, synthesizing oligonucleotides CUSTOMARRAY, INC. 2008-05-29 US claimed
US-20070065877-A1 Microarray having a base cleavable succinate linker COMBIMATRIX CORPORATION 2007-03-22 US claimed
US-20190227060-A1 MICROARRAY HAVING A BASE CLEAVABLE LINKER CUSTOMARRAY, INC. (US) 2019-07-25 US disclosed
US-10261075-B2 Microarray having a base cleavable linker CUSTOMARRAY, INC. (US) 2019-04-16 US disclosed
US-20180267032-A1 Microarray Having a Base Cleavable Linker CUSTOMARRAY, INC. (US) 2018-09-20 US disclosed
US-9983204-B2 Microarray having a base cleavable linker CUSTOMARRAY, INC. (US) 2018-05-29 US disclosed
US-20090280998-A1 Microarray having a base cleavable linker CUSTOMARRAY, INC. 2009-11-12 US disclosed
US-20080125327-A1 Bonding amino moieties to solid surface with reactive hydroxyl groups, bonding succinate moieties to the amine groups through amide bonds to form cleavable linkers attached to the solid surface, bonding a succinate group, a sugar group and a base group, synthesizing oligonucleotides CUSTOMARRAY, INC. 2008-05-29 US disclosed
US-20070065877-A1 Microarray having a base cleavable succinate linker COMBIMATRIX CORPORATION 2007-03-22 US disclosed