SCHEMBL7679461

SCHEMBL7679461

COC(=O)c1c(C)ccc(C)c1NC(=O)c1ccc(C)nc1C(=O)NCC1CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.39
CNR2 P34972 7/20 0.39
PTGER4 P35408 3/20 0.38
MAPK14 Q16539 5/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KIT P10721 1/20 0.37
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
BDKRB1 P46663 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
SCHEMBL7675254 0.92 POLB (0.39) CNR1CNR2PTGER4MAPK14MEN1
SCHEMBL678914 0.92 P2RX7 (0.38) CNR1CNR2MAPK14MEN1KMT2A
SCHEMBL7675273 0.86 P2RX7 (0.39) CNR1CNR2PTGER4MEN1KMT2A
SCHEMBL7682637 0.86 CNR1 (0.45) CNR1CNR2
SCHEMBL7684169 0.84 ALDH1A1 (0.37) MEN1KMT2A
SCHEMBL7677391 0.83 CNR1 (0.38) CNR1CNR2MEN1KMT2AACACB
SCHEMBL7679296 0.83 CNR1 (0.38) CNR1CNR2PTGER4MEN1KMT2A
SCHEMBL7676296 0.82 PTGER4 (0.40) CNR1CNR2PTGER4MAPK14MEN1
SCHEMBL7675255 0.82 CNR1 (0.40) CNR1CNR2PTGER4MAPK14KIT
SCHEMBL7677655 0.82 CNR2 (0.40) CNR1CNR2MAPK14MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6472349-B1 Pyridine-2,3-dicarboxylic acid diamides BASF AKTIENGESELLSCHAFT (DE) 2002-10-29 US claimed