SCHEMBL9465761

SCHEMBL9465761

O=C(C=C(c1cccs1)c1ccccc1Cl)C=C(c1cccs1)c1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ ALDH1A1 P00352 6/20 0.52
▸ MAPT P10636 4/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ LMNA P02545 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ KMT2A Q03164 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ CTNNB1 P35222 1/20 0.43
▸ WNT3A P56704 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ CES2 O00748 2/20 0.43
▸ CES1 P23141 2/20 0.43
▸ DAO P14920 1/20 0.42

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
SCHEMBL9467051 0.81 LMNA (0.45) TP53L3MBTL1ALDH1A1MAPTLMNA
SCHEMBL30421622 0.78 TP53 (0.66) TP53L3MBTL1ALDH1A1MAPTTDP1
SCHEMBL9821675 0.78 TP53 (0.66) TP53L3MBTL1ALDH1A1MAPTTDP1
SCHEMBL8900631 0.74 TP53 (0.60) TP53L3MBTL1ALDH1A1MAPTTDP1
SCHEMBL15979664 0.73 ALDH1A1 (0.68) TP53L3MBTL1ALDH1A1MAPTTDP1
SCHEMBL7201699 0.73 L3MBTL1 (0.68) TP53L3MBTL1ALDH1A1MAPTTDP1
SCHEMBL18050259 0.72 MAPT (0.59) TP53L3MBTL1ALDH1A1MAPTTDP1
SCHEMBL18050258 0.72 MAPT (0.59) TP53L3MBTL1ALDH1A1MAPTTDP1
1,2-Dichlorobenzene SCHEMBL29114306 0.71 DAO (0.76) TP53L3MBTL1ALDH1A1MAPTTDP1
Propionic Acid SCHEMBL9592677 0.70 ALOX15 (0.58) TP53L3MBTL1ALDH1A1MAPTTDP1

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
US-5252749-A Binding to serotonin receptors 5HT3, 5HT1D and 5HT1B; hypotensive agents; cardiovascular and psychological disorders ELF SANOFI (FR) 1993-10-12 — — US disclosed
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