SCHEMBL6222371

SCHEMBL6222371

CN1CC(C(=O)OCc2ccccc2)CC1=O

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.66
L3MBTL1 Q9Y468 2/20 0.60
ATM Q13315 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
BRD4 O60885 1/20 0.55
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 3/20 0.48
TSHR P16473 2/20 0.48
MAPK1 P28482 2/20 0.48
MAPT P10636 1/20 0.47

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
SCHEMBL27758268 0.83 HPGD (0.62) HPGDL3MBTL1ATMTDP1KMT2A
SCHEMBL19625794 0.81 HPGD (0.55) HPGDL3MBTL1ATMTDP1ALDH1A1
SCHEMBL16695405 0.80 KMT2A (0.67) HPGDL3MBTL1ATMTDP1KMT2A
SCHEMBL23966960 0.78 BRD4 (0.59) HPGDL3MBTL1BRD4ALDH1A1MAPK1
SCHEMBL12345122 0.77 ALDH1A1 (0.55) KMT2AALDH1A1TSHR
SCHEMBL795756 0.77 HPGD (0.54) HPGDL3MBTL1ATMTDP1KMT2A
SCHEMBL12667142 0.77 BRD4 (0.67) HPGDL3MBTL1BRD4KMT2AALDH1A1
SCHEMBL28956225 0.77 BRD4 (0.67) HPGDL3MBTL1BRD4KMT2AALDH1A1
SCHEMBL30282498 0.77 BRD4 (0.67) HPGDL3MBTL1BRD4KMT2AALDH1A1
SCHEMBL27047902 0.77 HPGD (0.52) HPGDL3MBTL1ATMALDH1A1

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
CN-104402791-A Preparation method for nebracetam UNIV HENAN NORMAL 2015-03-11 CN disclosed
EP-1537106-A1 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS Mitsubishi Pharma Corporation (JP) 2005-06-08 EP disclosed
WO-2004014910-A1 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS MITSUBISHI PHARMA CORPORATION (JP) 2004-02-19 WO disclosed