SCHEMBL27600451

SCHEMBL27600451

CCOC(=O)C(N)Cc1cc(F)ccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.46
ALDH1A1 P00352 5/20 0.46
SNCA P37840 2/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
FBP1 P09467 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 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
SCHEMBL27583161 0.87 MAPT (0.47) MAPTALDH1A1TDP1L3MBTL1MEN1
SCHEMBL27600605 0.85 KMT2A (0.49) MAPTALDH1A1ATMTDP1L3MBTL1
SCHEMBL2143592 0.83 GRIA2 (0.50) MAPTALDH1A1SNCAATMTDP1
SCHEMBL27600452 0.82 MAPT (0.41) MAPTALDH1A1SNCAATMTDP1
SCHEMBL8529543 0.82 L3MBTL1 (0.48) ALDH1A1L3MBTL1MEN1KMT2AMAPK1
SCHEMBL8529545 0.82 L3MBTL1 (0.48) ALDH1A1L3MBTL1MEN1KMT2AMAPK1
SCHEMBL10473975 0.79 MAPT (0.50) MAPTALDH1A1SNCAATMTDP1
SCHEMBL20543943 0.79 ALDH1A1 (0.47) MAPTALDH1A1TDP1
SCHEMBL17484695 0.78 MAPT (0.49) MAPTALDH1A1SNCAATMTDP1
SCHEMBL28749966 0.78 ALDH1A1 (0.43) MAPTALDH1A1TDP1L3MBTL1MEN1

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
CN-1476446-A Benzodiazepine derivative ֮����ʽ���� 2004-02-18 CN disclosed