SCHEMBL7803153

SCHEMBL7803153

Cc1c(-c2cccnc2)n(C)c2ccc(CCN(O)C(N)=O)cc12

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 4/20 0.51
TBXAS1 P24557 5/20 0.46
TACR1 P25103 2/20 0.39
CYP11B1 P15538 1/20 0.38
MAOA P21397 1/20 0.38
BACE1 P56817 1/20 0.38
PPARG P37231 1/20 0.37
MKNK1 Q9BUB5 2/20 0.35
MKNK2 Q9HBH9 2/20 0.35
PTGES2 Q9H7Z7 1/20 0.35
NR4A2 P43354 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL7811673 0.80 CYP11B2 (0.58) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7803165 0.80 CYP11B2 (0.48) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7803263 0.80 CYP11B2 (0.53) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7815564 0.80 CYP11B2 (0.64) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7817257 0.78 CYP11B2 (0.53) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7808262 0.77 CYP11B2 (0.52) CYP11B2TBXAS1CYP11B1MAOA
SCHEMBL7803182 0.77 CYP11B2 (0.49) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7803234 0.77 CYP11B2 (0.60) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7803145 0.75 TBXAS1 (0.55) CYP11B2TBXAS1TACR1CYP11B1MAOA
SCHEMBL7811601 0.75 TBXAS1 (0.55) CYP11B2TBXAS1CYP11B1PTGES2

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-0949259-B1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2001-06-20 EP disclosed
EP-0949259-A1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-10-13 EP disclosed