SCHEMBL29137983

SCHEMBL29137983

NC(=O)Oc1cc2c(C=O)cccc2cn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.34
PSMD14 O00487 1/20 0.33
STAMBP O95630 1/20 0.33
COPS5 Q92905 1/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ERN1 O75460 6/20 0.32
PARP1 P09874 2/20 0.32
KDM4E B2RXH2 2/20 0.31
HSD17B10 Q99714 1/20 0.31
PIM1 P11309 1/20 0.31
GAA P10253 1/20 0.31
NPC1 O15118 1/20 0.31
HSP90AA1 P07900 1/20 0.31
IDO1 P14902 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL29137977 0.88 PARP1 (0.39) MEN1KMT2APSMD14STAMBPCOPS5
SCHEMBL29137974 0.76 ERN1 (0.34) ERN1
SCHEMBL4073461 0.76 PLAU (0.46) MEN1KMT2APSMD14STAMBPCOPS5
SCHEMBL30636265 0.76 PLAU (0.46) MEN1KMT2APSMD14STAMBPCOPS5
SCHEMBL29137957 0.73 ERN1 (0.36) ALDH1A1ERN1L3MBTL1
SCHEMBL23976011 0.71 GABRP (0.37) MEN1KMT2AALDH1A1HPGDHTT
SCHEMBL29113189 0.69 MAPT (0.38) MEN1KMT2AERN1
SCHEMBL4020792 0.69 LMNA (0.39) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL17477194 0.66 ALDH1A1 (0.49) KMT2APTGDR2ALDH1A1HTTSMN1; SMN2
SCHEMBL28475692 0.66 MEN1 (0.41) 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
CN-117062804-A 1, 3-substituted cyclobutyl derivatives and their use 诺华股份有限公司 2023-11-14 CN disclosed