SCHEMBL29035247

SCHEMBL29035247

N=C(NO)c1cnc(COC(N)=O)s1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.33
LMNA P02545 1/20 0.32
TMPRSS15 P98073 1/20 0.31
PTGER1 P34995 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
SCHEMBL28639401 0.75 LMNA (0.36) LMNA
SCHEMBL25365142 0.74 HDAC6 (0.45) HDAC6
SCHEMBL29035194 0.69 PDPK1 (0.44) HDAC6LMNA
SCHEMBL29035492 0.69 LMNA (0.34) LMNA
SCHEMBL29208120 0.69 SMN1; SMN2 (0.37) LMNA
SCHEMBL2033202 0.68 NOS1 (0.39) HDAC6
SCHEMBL28457543 0.67 KDM4E (0.39) LMNA
SCHEMBL29035316 0.65
SCHEMBL23539953 0.64 HCAR2 (0.52) HDAC6
SCHEMBL28644238 0.64 LOXL2 (0.41) LMNA

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
CN-116437913-A Pharmaceutical compounds for treating complement-mediated disorders 艾其林医药公司 2023-07-14 CN disclosed