SCHEMBL20520940

SCHEMBL20520940

NC(=O)C1C(=O)N(c2ccccc2F)CC1C1CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
NOTUM Q6P988 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
GAA P10253 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FPR2 P25090 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
AADAT Q8N5Z0 1/20 0.35
GRM2 Q14416 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
GFER P55789 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
SCN9A Q15858 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SCN5A Q14524 1/20 0.34

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
SCHEMBL21638332 0.75 MEN1 (0.39) KMT2AMEN1NOTUMSIRT2SIRT1
SCHEMBL21638335 0.73 SIRT2 (0.41) KMT2AMEN1SIRT2SIRT1GAA
SCHEMBL12285262 0.72 KMT2A (0.47) KMT2AMEN1NOTUMSIRT2SIRT1
SCHEMBL25319499 0.71 ALDH1A1 (0.40) KMT2AMEN1SIRT2SIRT1ALDH1A1
SCHEMBL21638330 0.71 ALDH1A1 (0.40) KMT2AMEN1SIRT2SIRT1ALDH1A1
SCHEMBL6404663 0.67 KMT2A (0.44) KMT2AMEN1NOTUMSIRT2SIRT1
SCHEMBL25313673 0.66 KDM1A (0.36) SIRT2SIRT1AADATTSHR
SCHEMBL22769484 0.66 MEN1 (0.38) KMT2AMEN1SIRT2SIRT1AADAT
SCHEMBL892631 0.65 NOTUM (0.51) KMT2AMEN1NOTUMGAAFPR2
SCHEMBL25315680 0.65 SIRT2 (0.38) KMT2ANOTUMSIRT2SIRT1GAA

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
WO-2018178014-A1 4-CYCLOPROPYL-2-OXOPYRROLIDINE-3-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS HERBICIDAL PLANT PROTECTION AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2018-10-04 WO disclosed