SCHEMBL6834459

SCHEMBL6834459

OCCCCCN(Cc1ccccc1B(O)O)Cc1c2ccccc2cc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.37
ALDH1A1 P00352 3/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTR2A P28223 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 1/20 0.32
BCHE P06276 4/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 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
SCHEMBL17013844 0.86 ALDH1A1 (0.47) LIPGALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL17013838 0.82 CYP1A2 (0.48) LIPGALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL6834417 0.81 L3MBTL1 (0.43) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL976168 0.80 LIPG (0.40) LIPGKMT2ABCHEACHE
SCHEMBL1506800 0.80 APP (0.35) ALDH1A1KDM4ELMNAGAAL3MBTL1
SCHEMBL20926054 0.78 MAPT (0.36) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL4460221 0.77 CYP2D6 (0.50) LIPGCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL1506801 0.77 ALDH1A1 (0.39) LIPGALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL3292925 0.75 KDM4E (0.42) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL15586613 0.73 NQO2 (0.44) KDM4EBCHE

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-6804544-B2 GLUCOSE MEASUREMENT MINIMED, INC. 2004-10-12 US disclosed
EP-0862648-B1 DETECTION OF BIOLOGICAL MOLECULES USING CHEMICAL AMPLIFICATION AND OPTICAL SENSORS MEDTRONIC MINIMED INC (US) 2004-10-06 EP disclosed
US-6750311-B1 CONCENTRATION OF BLOOD GLUCOSE; BORONATE COMPLEX WITH A FLUORESCENT DYE; POLYURETHANE OR POLYUREA BIOCOMPATABLE MATRIX BY REACTION OF A DIISOCYANATE WITH A POLYMERIC DIOL OR POLYMERIC DIAMINE MINIMED INC. 2004-06-15 US disclosed
US-20020018843-A1 Detection of biological molecules using chemical amplification and optical sensors MINIMED INC. 2002-02-14 US disclosed
US-6319540-B1 IMMOBILIZING BORONIC ACID MOIETY IN SOLID SUPPORT BY ATTACHING TO A POLYMER MATRIX MINIMED INC. 2001-11-20 US disclosed
US-6011984-A Detection of biological molecules using chemical amplification and optical sensors MINIMED INC. (US) 2000-01-04 US disclosed
US-6002954-A IMPLANTABLE AMPLIFICATION SYSTEM THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-12-14 US disclosed
EP-0862648-A1 DETECTION OF BIOLOGICAL MOLECULES USING CHEMICAL AMPLIFICATION AND OPTICAL SENSORS Minimed Inc. (US) 1998-09-09 EP disclosed
WO-1997019188-A1 DETECTION OF BIOLOGICAL MOLECULES USING CHEMICAL AMPLIFICATION AND OPTICAL SENSORS MINIMED, INC. (US) 1997-05-29 WO disclosed