SCHEMBL8760753

SCHEMBL8760753

CC1CCC(Oc2cc(NC(=O)C3=C(C(=O)NC(C)c4ccccc4)CCCC3)c(F)cc2Cl)C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.37
DHODH Q02127 8/20 0.37
NR4A2 P43354 2/20 0.36
SCN9A Q15858 2/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
RORC P51449 1/20 0.36
PDE4D Q08499 3/20 0.35
PDE4A P27815 2/20 0.35
PDE4B Q07343 2/20 0.35
PDE4C Q08493 2/20 0.35
ACACB O00763 2/20 0.35
PTGER4 P35408 1/20 0.34

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
SCHEMBL8761242 0.91 PDE4D (0.43) NPSR1DHODHNR4A2SCN9ACNR1
SCHEMBL8761622 0.90 SCN9A (0.43) NPSR1DHODHNR4A2SCN9ACNR1
SCHEMBL8761538 0.83 SCN9A (0.38) NPSR1DHODHNR4A2SCN9ARORC
SCHEMBL8761735 0.80 SCN9A (0.47) NPSR1DHODHSCN9ARORCPDE4D
SCHEMBL8762025 0.78 ALOX15 (0.36) DHODHNR4A2SCN9ACNR1CNR2
SCHEMBL8759705 0.78 PDE4D (0.42) SCN9APDE4DPDE4APDE4BPDE4C
SCHEMBL8760416 0.76 SCN9A (0.43) NPSR1DHODHNR4A2SCN9ARORC
SCHEMBL8763493 0.75 SCN9A (0.43) NPSR1DHODHSCN9ARORCPDE4D
SCHEMBL8763572 0.74 NPSR1 (0.51) NPSR1DHODHNR4A2SCN9APDE4D
SCHEMBL9068411 0.74 PDE4D (0.43) NPSR1DHODHSCN9ACNR1CNR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635485-B1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEM RES (JP) 1997-06-11 EP disclosed
US-5554581-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-09-10 US disclosed
US-5506190-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-04-09 US disclosed
EP-0635485-A1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-01-25 EP disclosed