SCHEMBL7960880

SCHEMBL7960880

COC(=O)C1(NC(=O)Cc2c(C)cc(C)cc2OC)CCC(OC)CC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 2/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL7964389 0.91 LPAR1 (0.35) LPAR1NPC1RAB9AKMT2AKDM4E
SCHEMBL7949977 0.90 GAA (0.37) LPAR1NPC1RAB9AKMT2AKDM4E
SCHEMBL7964600 0.88 LPAR1 (0.33) LPAR1NPC1RAB9AKMT2AKDM4E
SCHEMBL7961784 0.88 MAPT (0.36) LPAR1MAPT
SCHEMBL7960018 0.87 LPAR1 (0.37) LPAR1NPC1RAB9AKDM4EHPGD
SCHEMBL7964520 0.87 S1PR5 (0.33) LPAR1NPC1RAB9AKMT2ALMNA
SCHEMBL8796214 0.87 LPAR1 (0.35) LPAR1NPC1RAB9AKMT2AKDM4E
SCHEMBL7949834 0.86 MAPT (0.38) LPAR1NPC1RAB9AKDM4EMAPT
SCHEMBL7960902 0.86 MAPT (0.38) LPAR1NPC1RAB9AKDM4EMAPT
SCHEMBL7960239 0.86 MAPT (0.38) LPAR1NPC1RAB9AKDM4EMAPT

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