SCHEMBL7960740

SCHEMBL7960740

COC(=O)C1(NC(=O)C(C)c2ccc(OC)cc2)CCCC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 1/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.42
GAA P10253 1/20 0.42
FAAH O00519 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
RAB9A P51151 1/20 0.40
CTSK P43235 1/20 0.40
MAPT P10636 2/20 0.39
CYP3A4 P08684 1/20 0.39
PPARG P37231 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL7964655 0.99 GPR88 (0.44) GPR88KMT2AMEN1GAAFAAH
SCHEMBL7964442 0.99 GPR88 (0.44) GPR88KMT2AMEN1GAAFAAH
SCHEMBL7949726 0.99 GPR88 (0.44) GPR88KMT2AMEN1GAAFAAH
SCHEMBL8698327 0.89 GPR88 (0.48) GPR88KMT2AMEN1GAAFAAH
SCHEMBL8697428 0.88 GPR88 (0.47) GPR88KMT2AMEN1GAAFAAH
SCHEMBL8701623 0.88 GPR88 (0.47) GPR88KMT2AMEN1GAAFAAH
SCHEMBL8703561 0.88 GPR88 (0.47) GPR88KMT2AMEN1GAAFAAH
SCHEMBL7950117 0.87 POLB (0.42) GPR88KMT2AMEN1GAATRPV1
SCHEMBL7960084 0.87 GPR88 (0.42) GPR88KMT2AMEN1GAARAB9A
SCHEMBL7957654 0.86 KMT2A (0.42) GPR88KMT2AMEN1GAARAB9A

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