SCHEMBL7964463

SCHEMBL7964463

COC(=O)C1(NC(=O)Cc2c(C)cc(C)cc2OC)CCCCC1C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LPAR1 Q92633 2/20 0.33
FKBP1A P62942 1/20 0.33
ALDH1A1 P00352 2/20 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
SCHEMBL8906344 0.92 GAA (0.34) MAPTLMNAHPGDL3MBTL1KMT2A
SCHEMBL7960620 0.92 NPC1 (0.36) NPC1RAB9AMAPTLMNAHPGD
SCHEMBL7960414 0.86 ALDH1A1 (0.36) MAPTHPGDMEN1KMT2AALDH1A1
SCHEMBL8796492 0.85 NPC1 (0.37) NPC1RAB9AMAPTLMNAHPGD
SCHEMBL7961784 0.81 MAPT (0.36) MAPTL3MBTL1LPAR1ALDH1A1
SCHEMBL8905461 0.81 GAA (0.36) LMNAHPGDKDM4EKMT2AALDH1A1
SCHEMBL8906967 0.81 L3MBTL1 (0.40) NPC1RAB9ALMNAHPGDKDM4E
SCHEMBL7960239 0.80 MAPT (0.38) NPC1RAB9AMAPTKDM4EL3MBTL1
SCHEMBL7960902 0.80 MAPT (0.38) NPC1RAB9AMAPTKDM4EL3MBTL1
SCHEMBL7949834 0.80 MAPT (0.38) NPC1RAB9AMAPTKDM4EL3MBTL1

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