SCHEMBL22907771

SCHEMBL22907771

CC#Cc1cc(C)c(C2C(=O)CC3CCC(CC2=O)CN(C(C)=O)C3)c(C)c1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA7 P36544 1/20 0.30
CHRNA4 P43681 1/20 0.30
DPP4 P27487 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
SCHEMBL22955563 0.87 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4DPP4
SCHEMBL22955446 0.82 SLC9A1 (0.33) CNR1
SCHEMBL22954995 0.81 HTR2A (0.33)
SCHEMBL22955488 0.80 ACACB (0.33) CNR1MEN1KMT2A
SCHEMBL23344423 0.78 CNR1 (0.32) CNR1
SCHEMBL23748396 0.77
SCHEMBL22955124 0.77 KDM1A (0.35) CNR1MEN1KMT2ACHRNB2CHRNB4
SCHEMBL22907832 0.76 ACACB (0.32) CNR1
SCHEMBL22955549 0.76 RECQL (0.35)
SCHEMBL21274392 0.75 USP2 (0.35) MEN1KMT2A

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
WO-2021009232-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-01-21 WO disclosed