SCHEMBL16693294

SCHEMBL16693294

C=C(C)C(=O)OCCNC(=O)c1ccc(/N=N/c2cc(C(=O)c3ccccc3)c(O)cc2OCC)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT5 Q9NXA8 2/20 0.37
NME4 O00746 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
CHRM1 P11229 1/20 0.37
ADORA2A P29274 1/20 0.37
AVPR2 P30518 1/20 0.37
AGTR1 P30556 1/20 0.37
SLC6A4 P31645 1/20 0.37
AVPR1A P37288 1/20 0.37
HTR3A P46098 1/20 0.37
GCDH Q92947 1/20 0.37
SLC29A1 Q99808 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
TP53 P04637 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
HPGD P15428 5/20 0.36

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
SCHEMBL16693258 0.93 GAA (0.37) TP53MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL16693291 0.92 MAPT (0.43) SIRT5NME4ADORA3CHRM1ADORA2A
SCHEMBL16693392 0.91 SIRT5 (0.41) SIRT5NME4ADORA3CHRM1ADORA2A
SCHEMBL16693324 0.89 RAB9A (0.38) SIRT5NME4ADORA3CHRM1ADORA2A
SCHEMBL16693285 0.88 MAPT (0.38) TDP1MEN1KMT2ARAB9AHPGD
SCHEMBL16693249 0.86 LMNA (0.38) MEN1KMT2ARAB9AHPGDLMNA
SCHEMBL16693232 0.85 SIRT5 (0.52) SIRT5NME4ADORA3CHRM1ADORA2A
SCHEMBL16693248 0.85 HPGD (0.42) MEN1KMT2ARAB9ASMN1; SMN2HPGD
SCHEMBL16693259 0.84 MAPT (0.43) MEN1KMT2ARAB9ASMN1; SMN2HPGD
SCHEMBL16693313 0.83 SMN1; SMN2 (0.38) SIRT5NME4ADORA3CHRM1ADORA2A

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