SCHEMBL4673791

SCHEMBL4673791

CCNC(=O)c1ccncc1N

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
ALDH1A1 P00352 3/20 0.58
GAA P10253 3/20 0.58
GLA P06280 1/20 0.58
KDM4C Q9H3R0 5/20 0.56
KDM6B O15054 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
MEN1 O00255 1/20 0.56
KDM4A O75164 1/20 0.56
MAPT P10636 1/20 0.56
THRB P10828 1/20 0.56
KMT2A Q03164 1/20 0.56
KDM4D Q6B0I6 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KDM5A P29375 1/20 0.44
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
HPGD P15428 1/20 0.40
PIM1 P11309 1/20 0.40
BAD Q92934 1/20 0.40

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
SCHEMBL14917464 0.87 KDM4E (0.46) KDM4EALDH1A1GAAGLAKDM4C
Hydrochloric Acid SCHEMBL6690853 0.86 KDM4E (0.54) KDM4EALDH1A1GAAGLAKDM4C
SCHEMBL17163979 0.82 KDM4C (0.59) KDM4EALDH1A1GAAGLAKDM4C
SCHEMBL15402395 0.82 KDM4E (0.54) KDM4EALDH1A1GAAGLAKDM4C
SCHEMBL2694735 0.81 KDM4E (0.60) KDM4EALDH1A1GAAGLAKDM4C
SCHEMBL7453387 0.81 KDM4E (0.53) KDM4EALDH1A1GAAGLAKDM4C
SCHEMBL17439049 0.81 KDM5A (0.48) KDM4EALDH1A1GAAGLAKDM4C
SCHEMBL1232893 0.81 KDM4E (0.64) KDM4EALDH1A1GAAGLAKDM4C
SCHEMBL12516911 0.80 KDM4C (0.53) KDM4EALDH1A1GAAKDM4CKDM6B
SCHEMBL17438513 0.80 KDM5A (0.47) KDM4EALDH1A1GAAGLAKDM4C

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-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP disclosed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO disclosed