SCHEMBL1434446

SCHEMBL1434446

CCOC(=O)n1ncc2c1CCNC2

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35
SLC6A3 Q01959 3/20 0.35
HTR6 P50406 1/20 0.35
F12 P00748 2/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
S1PR1 P21453 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
HPGD P15428 1/20 0.32
PNMT P11086 1/20 0.32
PLAT P00750 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL1433995 0.91 ALDH1A1 (0.33) ADORA1SLC6A2SLC6A4SLC6A3HTR6
SCHEMBL1434695 0.91 PLAT (0.33) HTR6F12S1PR1PNMTPLAT
SCHEMBL29507376 0.87 KMT2A (0.35) LMNAKMT2AALDH1A1MEN1GAA
SCHEMBL1433863 0.87 HTR6 (0.31) HTR6S1PR1TSHR
SCHEMBL1433585 0.86 CHRM3 (0.36) HTR6S1PR1PNMT
SCHEMBL6420852 0.82 ELANE (0.48) HTR6S1PR1MAPTPNMT
SCHEMBL1433350 0.82 S1PR1 (0.40) HTR6F12S1PR1PNMTPLAT
SCHEMBL8132784 0.80 SMN1; SMN2 (0.43) KMT2AALDH1A1MEN1GAATSHR
Hydrochloric Acid SCHEMBL7988687 0.79 SMN1; SMN2 (0.42) LMNAKMT2AALDH1A1MEN1GAA
Hydrochloric Acid SCHEMBL7975255 0.79 SMN1; SMN2 (0.42) LMNAKMT2AALDH1A1MEN1GAA

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-2300436-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS Nerviano Medical Sciences S.r.l. (IT) 2011-03-30 EP claimed
EP-2300436-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS Nerviano Medical Sciences S.r.l. (IT) 2011-03-30 EP disclosed