SCHEMBL7669358

SCHEMBL7669358

CCOC(=O)COc1nc(-c2ccccc2)nc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
POLB P06746 2/20 0.61
CYP1A2 P05177 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
RXFP1 Q9HBX9 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
TSPO P30536 3/20 0.57
PDE5A O76074 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
MAPT P10636 3/20 0.55
GAA P10253 1/20 0.54
HPGD P15428 2/20 0.54
SQOR Q9Y6N5 1/20 0.52
TSHR P16473 1/20 0.51

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
SCHEMBL7674183 0.86 PDE5A (0.65) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL7669775 0.85 PDE5A (0.64) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL10674567 0.84 TSPO (0.70) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL7501749 0.83 SQOR (0.53) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL28408860 0.83 KDM4E (0.53) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL7673162 0.82 MEN1 (0.83) L3MBTL1POLBCYP1A2CYP2C19MEN1
SCHEMBL7674176 0.78 PRNP (0.59) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL10677871 0.77 PRNP (0.65) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL10756337 0.77 MAPT (0.61) PRNPL3MBTL1POLBCYP1A2CYP2C9
SCHEMBL7669768 0.76 PRNP (0.57) PRNPL3MBTL1POLBCYP1A2CYP2C9

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