SCHEMBL2654930

SCHEMBL2654930

C=CC(O)c1ccc(C=O)c2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
LMNA P02545 2/20 0.37
THRB P10828 1/20 0.37
BLM P54132 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 1/20 0.37
HSP90AA1 P07900 1/20 0.37
IDO1 P14902 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
CYP2A6 P11509 2/20 0.34
IMPDH2 P12268 2/20 0.34
MCL1 Q07820 1/20 0.33
ALDH1A1 P00352 3/20 0.33
PADI4 Q9UM07 1/20 0.32

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
SCHEMBL2649379 0.77 KMT2A (0.36) MEN1KMT2ALMNATHRBBLM
SCHEMBL1325378 0.77 LMNA (0.48) MEN1KMT2ALMNATHRBBLM
Benzene SCHEMBL7542715 0.77 KMT2A (0.46) MEN1KMT2ALMNATHRBBLM
SCHEMBL982388 0.76 KMT2A (0.61) MEN1KMT2ALMNATHRBBLM
SCHEMBL28682429 0.76 MEN1 (0.41) MEN1KMT2ALMNATHRBBLM
SCHEMBL29786760 0.76 KMT2A (0.61) MEN1KMT2ALMNATHRBBLM
SCHEMBL2646640 0.73 IMPDH2 (0.34) MEN1KMT2ALMNATHRBBLM
SCHEMBL27958818 0.73 MEN1 (0.38) MEN1KMT2ALMNATHRBBLM
SCHEMBL1325659 0.72 CYP1A2 (0.50) MEN1KMT2ATDP1KDM4ECYP2A6
SCHEMBL7594286 0.71 ALDH1A1 (0.39) MEN1KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6613942-B1 Nonpeptide; 4-hydroxy benzoic acid hydrazides NOVO NORDISK A/S (DK) 2003-09-02 US disclosed
EP-1140823-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2001-10-10 EP disclosed
WO-2000039088-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-07-06 WO disclosed