SCHEMBL7815564

SCHEMBL7815564

Cc1c(-c2cccnc2)n(C)c2ccc(CO)cc12

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 5/20 0.64
MKNK1 Q9BUB5 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
TBXAS1 P24557 5/20 0.47
CYP11B1 P15538 2/20 0.46
MAOA P21397 1/20 0.46
FYN P06241 2/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
TACR1 P25103 1/20 0.39
VHL P40337 1/20 0.38
PPARG P37231 1/20 0.37
CYP2A6 P11509 1/20 0.37
DYRK1A Q13627 1/20 0.37
NR4A2 P43354 1/20 0.37

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 0.88 CYP11B2 (0.58) CYP11B2MKNK1MKNK2TBXAS1CYP11B1
SCHEMBL7803234 0.87 CYP11B2 (0.60) CYP11B2MKNK1MKNK2TBXAS1CYP11B1
SCHEMBL7803263 0.81 CYP11B2 (0.53) CYP11B2TBXAS1CYP11B1MAOATACR1
SCHEMBL7817257 0.81 CYP11B2 (0.53) CYP11B2TBXAS1CYP11B1MAOATACR1
SCHEMBL7815329 0.81 CYP11B2 (0.68) CYP11B2TBXAS1CYP11B1MAOAPPARG
SCHEMBL7803153 0.80 CYP11B2 (0.51) CYP11B2MKNK1MKNK2TBXAS1CYP11B1
SCHEMBL1606034 0.78 CYP11B2 (1.00) CYP11B2TBXAS1CYP11B1MAOACYP2A6
SCHEMBL7803219 0.78 CYP11B2 (0.64) CYP11B2TBXAS1CYP11B1MAOACYP2A6
SCHEMBL7812395 0.76 CYP11B2 (0.58) CYP11B2TBXAS1CYP11B1MAOAABCG2
SCHEMBL7803167 0.72 CYP11B2 (0.50) CYP11B2TBXAS1CYP11B1MAOATACR1

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