Phenylboronic Acid

Phenylboronic Acid

SCHEMBL6530013

CCOC(=O)c1cc2c(ccc(=O)n2-c2ccccc2)n1Cc1ccccc1.OB(O)c1ccccc1

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.51
TDP1 Q9NUW8 6/20 0.51
ALDH1A1 P00352 4/20 0.51
TSHR P16473 3/20 0.51
POLB P06746 3/20 0.51
ATM Q13315 1/20 0.51
NOD2 Q9HC29 1/20 0.47
NOD1 Q9Y239 1/20 0.47
KDM4E B2RXH2 5/20 0.46
MAPK1 P28482 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
F10 P00742 2/20 0.43
LMNA P02545 2/20 0.43
GAA P10253 2/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 1/20 0.42

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
SCHEMBL4716102 0.93 MAPT (0.57) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4712174 0.86 MAPT (0.51) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4789434 0.86 ALDH1A1 (0.53) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4711774 0.82 MAPT (0.51) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4715422 0.82 MAPT (0.48) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4716291 0.80 NOD2 (0.52) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4789540 0.78 MAPT (0.49) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4714118 0.75 MAPT (0.47) MAPTTDP1ALDH1A1TSHRPOLB
SCHEMBL4711636 0.74 MEN1 (0.47) MAPTALDH1A1POLBKDM4EL3MBTL1
SCHEMBL4716301 0.72 MAPT (0.44) MAPTTDP1ALDH1A1TSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549648-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS Celltech R & D Limited (GB) 2005-07-06 EP disclosed
WO-2004031188-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS CELLTECH R & D LIMITED (GB) 2004-04-15 WO disclosed