SCHEMBL7957892

SCHEMBL7957892

CCC(CC)(NC(=O)Cc1c(C)cc(C)cc1OC)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LPAR1 Q92633 1/20 0.36
KMT2A Q03164 2/20 0.34
CNR2 P34972 2/20 0.34
PKM P14618 2/20 0.34
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EPHX2 P34913 1/20 0.33
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL9593911 0.90 HPGD (0.36) LMNASMN1; SMN2L3MBTL1KMT2ACNR2
SCHEMBL7959947 0.90 SMN1; SMN2 (0.36) LMNASMN1; SMN2L3MBTL1LPAR1KMT2A
SCHEMBL7960936 0.84 LMNA (0.40) LMNASMN1; SMN2L3MBTL1LPAR1KMT2A
SCHEMBL7959906 0.82 KMT2A (0.39) LMNASMN1; SMN2L3MBTL1KMT2AALDH1A1
SCHEMBL6994763 0.81 LMNA (0.37) LMNASMN1; SMN2L3MBTL1LPAR1KMT2A
SCHEMBL6990974 0.79 TAS1R3 (0.43) LMNASMN1; SMN2L3MBTL1LPAR1KMT2A
SCHEMBL7960037 0.78 SMN1; SMN2 (0.40) LMNASMN1; SMN2L3MBTL1LPAR1KMT2A
SCHEMBL7958365 0.76 SMN1; SMN2 (0.37) LMNASMN1; SMN2L3MBTL1LPAR1KMT2A
SCHEMBL8863114 0.76 P2RX7 (0.41) SMN1; SMN2KMT2AALDH1A1MEN1MAPT
SCHEMBL6921814 0.75 ALDH1A1 (0.45) SMN1; SMN2L3MBTL1KMT2APKMALDH1A1

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-6172255-B1 INSECTICIDES; MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-01-09 US disclosed
US-5830826-A Alkoxy-alkyl-substituted 1H-3-aryl-pyrrolidine-2, 4-diones used as herbicicides and pesticides BAYER AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed