SCHEMBL6174339

SCHEMBL6174339

CCOc1cccc(-c2ncccc2C(N)=O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTK P33981 2/20 0.52
MAPK8 P45983 2/20 0.52
DHODH Q02127 3/20 0.51
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
MKNK2 Q9HBH9 2/20 0.48
MKNK1 Q9BUB5 1/20 0.48
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
NTRK1 P04629 2/20 0.46
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
NOTUM Q6P988 1/20 0.44
ICMT O60725 1/20 0.44
JAK2 O60674 1/20 0.43
THRB P10828 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
DYRK3 O43781 1/20 0.43

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
SCHEMBL6174210 0.86 JAK2 (0.56) DHODHKDM4EJAK2CLK4
SCHEMBL27999916 0.85 PARP10 (0.51) TTKMAPK8MKNK2MKNK1GAA
SCHEMBL6174664 0.81 KCNA5 (0.49) DHODHRPS6KB1PDE4AKCNH2
SCHEMBL29927604 0.80 LRRK2 (0.44) MKNK2JAK2DYRK3MAP4K4PIM1
SCHEMBL29927573 0.80 DYRK3 (0.39) TTKMAPK8DHODHMKNK2NTRK1
SCHEMBL18580116 0.79 TLR8 (0.51) DHODHMKNK2MKNK1MAPTKDM4E
SCHEMBL29927534 0.77 JAK2 (0.37) TTKMAPK8DHODHMKNK2KDM4E
SCHEMBL16277176 0.77 KDM4E (0.58) DHODHMAPTKDM4EALDH1A1HPGD
SCHEMBL2991676 0.76 LMNA (0.57) MKNK2MAPTKDM4EJAK2TDP1
SCHEMBL27964788 0.76 RORB (0.68) ALDH1A1HPGDJAK2RPS6KB1PDE4A

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-1575918-A2 SUBSTITUTED BIARYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2005-09-21 EP claimed
WO-2004056774-A2 SUBSTITUTED BIPHENYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2004-07-08 WO claimed