SCHEMBL7959929

SCHEMBL7959929

CCCC(C)(NC(=O)C(C)c1ccc(C)cc1OC)C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.43
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GPR139 Q6DWJ6 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NPBWR1 P48145 1/20 0.35
MCHR1 Q99705 1/20 0.35
GAA P10253 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL7958367 0.91 LPAR1 (0.43) LPAR1RAB9ANPC1KDM4EGPR139
SCHEMBL7960940 0.83 LPAR1 (0.48) LPAR1RAB9ANPC1GPR139KMT2A
SCHEMBL7957895 0.82 LPAR1 (0.46) LPAR1RAB9ANPC1KDM4EGPR139
SCHEMBL7957914 0.82 TAS1R3 (0.44) LPAR1RAB9ANPC1KDM4EGPR139
SCHEMBL7961961 0.82 MTNR1A (0.35) HTT
SCHEMBL7960040 0.78 LPAR1 (0.48) LPAR1RAB9ANPC1KDM4EGPR139
SCHEMBL8701833 0.78 LPAR1 (0.46) LPAR1RAB9ANPC1KDM4ESMN1; SMN2
SCHEMBL7964513 0.77 LPAR1 (0.43) LPAR1RAB9ANPC1KDM4EALDH1A1
SCHEMBL27385599 0.75 L3MBTL1 (0.42) SMN1; SMN2LMNAMAPTHTTALDH1A1
SCHEMBL7961964 0.75 GPR88 (0.46) RAB9AMEN1LMNAKMT2AGAA

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