SCHEMBL7846077

SCHEMBL7846077

Cc1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1Nc1cccc(OCc2ccccc2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.73
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
SMO Q99835 1/20 0.58
MAPT P10636 2/20 0.55
USP2 O75604 1/20 0.55
MAPK1 P28482 1/20 0.55
ESR2 Q92731 1/20 0.55
TAAR1 Q96RJ0 1/20 0.55
BRAF P15056 3/20 0.55
RAF1 P04049 2/20 0.55
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
DGAT1 O75907 1/20 0.52
SIRT2 Q8IXJ6 1/20 0.51

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
SCHEMBL2968436 0.93 MAPK14 (0.82) MAPK14KMT2AMEN1SMOMAPT
SCHEMBL7807977 0.89 MAPK14 (0.78) MAPK14KMT2AMEN1SMOMAPT
SCHEMBL6485519 0.87 MAPK14 (0.89) MAPK14KMT2AMEN1SMOMAPT
SCHEMBL7807923 0.86 MAPK14 (0.85) MAPK14KMT2AMEN1SMOMAPT
SCHEMBL7838866 0.86 MAPK14 (0.65) MAPK14BRAFRAF1DGAT1
SCHEMBL7856635 0.85 MAPK14 (0.57) MAPK14SMOBRAFRAF1
SCHEMBL6477445 0.84 MAPK14 (1.00) MAPK14KMT2AMEN1SMOMAPT
SCHEMBL7846779 0.84 MAPK14 (0.60) MAPK14SMOBRAFRAF1
SCHEMBL2345986 0.83 KMT2A (0.67) MAPK14KMT2AMEN1SMOMAPT
SCHEMBL7846789 0.81 MAPK14 (0.55) MAPK14LMNA

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-1102743-A1 AMIDE DERIVATIVES WHICH ARE USEFUL AS CYTOKINE INHIBITORS AstraZeneca AB (SE) 2001-05-30 EP disclosed
WO-2000007980-A1 AMIDE DERIVATIVES WHICH ARE USEFUL AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2000-02-17 WO disclosed