SCHEMBL29664349

SCHEMBL29664349

Cc1cc(O)c([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 6/20 0.52
ALDH1A1 P00352 4/20 0.50
TSHR P16473 4/20 0.48
MAPK1 P28482 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HPGD P15428 2/20 0.48
TP53 P04637 1/20 0.48
HSD17B10 Q99714 3/20 0.47
RECQL P46063 2/20 0.47
ALOX15 P16050 2/20 0.47
CYP3A4 P08684 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MAPT P10636 3/20 0.44
ALDH5A1 P51649 1/20 0.44
ABAT P80404 1/20 0.44
CA12 O43570 1/20 0.44

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
SCHEMBL8580180 1.00 GPR35 (0.52) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL11547714 0.91 GPR35 (0.52) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL62337 0.89 GPR35 (0.54) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL29510944 0.89 SNCA (0.55) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL7937707 0.89 SNCA (0.55) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL29535223 0.87 GPR35 (0.52) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL799388 0.87 GPR35 (0.52) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL7027831 0.85 GPR35 (0.50) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL5311206 0.84 TSHR (0.56) GPR35ALDH1A1TSHRSMN1; SMN2HPGD
SCHEMBL70180 0.84 GPR35 (0.58) GPR35ALDH1A1TSHRMAPK1SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114605764-B Carrier composition for inorganic microparticle dispersion, slurry composition for inorganic microparticle dispersion, and method for producing inorganic microparticle-dispersed sheet 积水化学工业株式会社 2024-01-19 CN disclosed
CN-111771885-B Pest control composition comprising novel iminopyridine derivatives 株式会社MMAG 2022-05-17 CN disclosed