SCHEMBL21393693

SCHEMBL21393693

C=C(C/C=N\c1ncn(C)c1C(C)=O)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32

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
SCHEMBL21393690 0.77 APOBEC3A (0.35) APOBEC3AAPOBEC3G
SCHEMBL21393789 0.73
SCHEMBL25562761 0.60 APOBEC3A (0.39) APOBEC3AAPOBEC3G
SCHEMBL19235764 0.60 APOBEC3A (0.41) APOBEC3AAPOBEC3G
SCHEMBL18477792 0.58
SCHEMBL23718340 0.56 APOBEC3A (0.41) APOBEC3AAPOBEC3G
SCHEMBL22209898 0.56 APOBEC3A (0.35) APOBEC3AAPOBEC3G
SCHEMBL21367563 0.54
SCHEMBL21879818 0.54 APOBEC3A (0.42) APOBEC3AAPOBEC3G
SCHEMBL21393576 0.52 TDP1 (0.31)

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