SCHEMBL7674176

SCHEMBL7674176

CCOC(=O)C(CC)Oc1nc(-c2ccccc2)nc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
MAPT P10636 2/20 0.59
TSPO P30536 4/20 0.55
CYP1A2 P05177 1/20 0.53
POLB P06746 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PDE5A O76074 2/20 0.49
ALDH1A1 P00352 1/20 0.49
ATM Q13315 2/20 0.49
HPGD P15428 2/20 0.47
GAA P10253 2/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TSHR P16473 1/20 0.45

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
SCHEMBL7669768 0.91 PRNP (0.57) PRNPL3MBTL1MAPTTSPOCYP1A2
SCHEMBL7669358 0.78 PRNP (0.61) PRNPL3MBTL1MAPTTSPOCYP1A2
SCHEMBL10756337 0.75 MAPT (0.61) PRNPL3MBTL1MAPTTSPOCYP1A2
SCHEMBL7674183 0.75 PDE5A (0.65) PRNPL3MBTL1MAPTTSPOCYP1A2
SCHEMBL10674310 0.75 TSPO (0.67) PRNPL3MBTL1MAPTTSPOMEN1
SCHEMBL7673162 0.74 MEN1 (0.83) L3MBTL1MAPTTSPOCYP1A2POLB
SCHEMBL7669775 0.74 PDE5A (0.64) PRNPL3MBTL1MAPTTSPOCYP1A2
SCHEMBL25370611 0.72 PPARG (0.43) PRNPL3MBTL1MAPTTDP1MEN1
SCHEMBL10674567 0.72 TSPO (0.70) PRNPL3MBTL1MAPTTSPOCYP1A2
SCHEMBL10673035 0.71 TSPO (1.00) PRNPL3MBTL1TSPOCYP1A2POLB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6479499-B1 INHIBITORS OF TUBULIN POLYMERIZATION NATIONAL SCIENCE COUNCIL (TW) 2002-11-12 US disclosed