SCHEMBL16693232

SCHEMBL16693232

C=C(C)C(=O)OCCNC(=O)c1ccc(/N=N/c2ccc(O)c(C(=O)c3ccccc3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT5 Q9NXA8 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
NME4 O00746 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
CHRM1 P11229 1/20 0.52
ADORA2A P29274 1/20 0.52
AVPR2 P30518 1/20 0.52
AGTR1 P30556 1/20 0.52
SLC6A4 P31645 1/20 0.52
AVPR1A P37288 1/20 0.52
HTR3A P46098 1/20 0.52
GCDH Q92947 1/20 0.52
SLC29A1 Q99808 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 3/20 0.41
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 1/20 0.39
PRKCG P05129 1/20 0.39
PRKCB P05771 1/20 0.39

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
SCHEMBL16693311 0.93 NME4 (0.44) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693392 0.91 SIRT5 (0.41) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693291 0.87 MAPT (0.43) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693327 0.86 ELANE (0.40) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693254 0.85 SIRT5 (0.53) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693294 0.85 SIRT5 (0.37) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693313 0.84 SMN1; SMN2 (0.38) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693317 0.84 L3MBTL1 (0.41) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693318 0.82 PTGES (0.42) SIRT5TDP1NME4ADORA3CHRM1
SCHEMBL16693267 0.81 KMT2A (0.39) TDP1SMN1; SMN2HPGDALDH1A1MEN1

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-2015064674-A1 METHOD FOR MANUFACTURING POLYMERIZABLE UV-ABSORBING DYE 興和株式会社 2015-05-07 WO disclosed