SCHEMBL9446231

SCHEMBL9446231

CCOC(=O)c1c(C)noc1C(=O)Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
PKM P14618 3/20 0.49
KDM4E B2RXH2 4/20 0.48
POLB P06746 2/20 0.48
TSHR P16473 1/20 0.46
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
HTT P42858 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PDE4D Q08499 1/20 0.45
CACNA1F O60840 2/20 0.42
CACNA1D Q01668 2/20 0.42
CACNA1S Q13698 2/20 0.42
CACNA1C Q13936 2/20 0.42
HPGD P15428 3/20 0.40
ATM Q13315 1/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL9446167 0.88 ALDH1A1 (0.52) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL1641384 0.85 ALDH1A1 (0.50) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL9446171 0.85 ALDH1A1 (0.50) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL9446211 0.83 ALDH1A1 (0.49) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL9446166 0.80 TSHR (0.48) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL20027632 0.79 ALDH1A1 (0.51) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL2775305 0.79 ALDH1A1 (0.58) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL9524704 0.78 ALDH1A1 (0.47) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL14710756 0.77 ALDH1A1 (0.52) ALDH1A1PKMKDM4EPOLBTSHR
SCHEMBL6768686 0.76 ALDH1A1 (0.57) ALDH1A1PKMKDM4EPOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5205854-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1993-04-27 US disclosed
US-5080708-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1992-01-14 US disclosed