SCHEMBL21393695

SCHEMBL21393695

C=Cn1c(C=O)cccc1=O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
ATM Q13315 1/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.32
CYP1A2 P05177 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL21393370 0.79 TRIM24 (0.38) TRIM24TRIM33ATM
SCHEMBL17821042 0.70 TRIM24 (0.50) TRIM24TRIM33ATMALDH1A1GAA
SCHEMBL21393349 0.67 IDH1 (0.37) ALDH1A1GAA
SCHEMBL21393358 0.64 SMN1; SMN2 (0.31)
SCHEMBL8604090 0.61 CA12 (0.52) ALDH1A1L3MBTL1
SCHEMBL29611953 0.61 CA12 (0.52) ALDH1A1L3MBTL1
SCHEMBL14993028 0.60
SCHEMBL27589630 0.60
SCHEMBL536875 0.59
SCHEMBL6366952 0.59 SMN1; SMN2 (0.38) ALDH1A1GAAL3MBTL1

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-2019182925-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-26 WO disclosed