SCHEMBL9302272

SCHEMBL9302272

CCn1c2cc(N3CCN(C(=O)OC(C)(C)C)CC3)c(F)cc2n2c(=O)[nH]c(=O)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 3/20 0.42
POLB P06746 2/20 0.42
TSHR P16473 2/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 2/20 0.39
KCNH2 Q12809 1/20 0.39
THRB P10828 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 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
SCHEMBL9304073 0.84 MAPT (0.39) MAPTALDH1A1KDM4EHSD17B10POLB
SCHEMBL9301938 0.83 DRD3 (0.43) ALDH1A1KDM4EPOLBGAAHPGD
SCHEMBL9302904 0.81 ALDH1A1 (0.45) MAPTALDH1A1KDM4EHSD17B10POLB
SCHEMBL22724875 0.75 ALDH1A1 (0.48) MAPTALDH1A1KDM4EHSD17B10POLB
SCHEMBL21937028 0.72 MAPT (0.51) MAPTALDH1A1KDM4EHSD17B10POLB
Potassium SCHEMBL9744154 0.72 HSD17B10 (0.45) MAPTALDH1A1KDM4EHSD17B10POLB
SCHEMBL9744143 0.72 HSD17B10 (0.45) MAPTALDH1A1KDM4EHSD17B10POLB
Potassium Ion SCHEMBL9744147 0.71 ALDH1A1 (0.42) MAPTALDH1A1KDM4EHSD17B10POLB
SCHEMBL24125575 0.69 MAPT (0.47) MAPTALDH1A1KDM4EHSD17B10POLB
SCHEMBL9302880 0.69 HTT (0.46) MAPTALDH1A1KDM4EHSD17B10POLB

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-5283248-A Bactericides, enzyme inhibitor of DNA-gyrase in bacteria HOFFMANN-LA ROCHE INC. (US) 1994-02-01 US disclosed