SCHEMBL7803182

SCHEMBL7803182

CCC(c1ccc2c(c1)c(C)c(-c1cccnc1)n2C)N(O)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 5/20 0.49
TBXAS1 P24557 5/20 0.42
CYP11B1 P15538 2/20 0.39
MAOA P21397 1/20 0.39
MKNK1 Q9BUB5 2/20 0.35
MKNK2 Q9HBH9 2/20 0.35
TACR1 P25103 1/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
KCNH2 Q12809 3/20 0.34
ATM Q13315 1/20 0.34
DYRK1A Q13627 1/20 0.34
NR4A2 P43354 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
SCHEMBL7808262 0.87 CYP11B2 (0.52) CYP11B2TBXAS1CYP11B1MAOAAKR1C3
SCHEMBL7815761 0.78 CYP11B2 (0.47) CYP11B2TBXAS1CYP11B1MAOADYRK1A
SCHEMBL7803153 0.77 CYP11B2 (0.51) CYP11B2TBXAS1CYP11B1MAOAMKNK1
SCHEMBL7803165 0.75 CYP11B2 (0.48) CYP11B2TBXAS1CYP11B1MAOAMKNK1
SCHEMBL7815564 0.72 CYP11B2 (0.64) CYP11B2TBXAS1CYP11B1MAOAMKNK1
SCHEMBL7803234 0.71 CYP11B2 (0.60) CYP11B2TBXAS1CYP11B1MAOAMKNK1
SCHEMBL7812395 0.70 CYP11B2 (0.58) CYP11B2TBXAS1CYP11B1MAOANR4A2
SCHEMBL7815329 0.70 CYP11B2 (0.68) CYP11B2TBXAS1CYP11B1MAOADYRK1A
SCHEMBL7803219 0.69 CYP11B2 (0.64) CYP11B2TBXAS1CYP11B1MAOADYRK1A
SCHEMBL7811657 0.69 NR4A2 (0.45) AKR1C3AKR1C2NR4A2

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
EP-0949259-B1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2001-06-20 EP disclosed
US-6184238-B1 ANTIALLERGENS, ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-02-06 US disclosed
EP-0949259-A1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-10-13 EP disclosed