SCHEMBL8434720

SCHEMBL8434720

C=C(CSCCNC(=O)COCC(=O)O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ ALDH1A1 P00352 8/20 0.41
▸ HPGD P15428 7/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ POLB P06746 3/20 0.40
▸ MAPT P10636 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ HTT P42858 1/20 0.38
▸ GAA P10253 1/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 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
SCHEMBL8434069 0.81 LMNA (0.50) ALDH1A1HPGDSMN1; SMN2LMNAPOLB
SCHEMBL8432568 0.78 ALDH1A1 (0.36) NPC1ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL7900079 0.73 CYP2C19 (0.53) USP2ALDH1A1SMN1; SMN2LMNAPOLB
SCHEMBL8434924 0.71 LMNA (0.40) NPC1ALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL7900060 0.70 ALDH1A1 (0.66) ALDH1A1HPGDSMN1; SMN2MAPTTDP1
SCHEMBL11359120 0.70 ESR1 (0.56) ALDH1A1HPGDSMN1; SMN2MAPTL3MBTL1
SCHEMBL8745142 0.70 ALDH1A1 (0.48) USP2ALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL7900084 0.67 MAOA (0.42) USP2ALDH1A1HPGDMAPTTDP1
SCHEMBL7734314 0.67 HPGD (0.55) USP2NPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL3194897 0.67 TDP1 (0.54) NPC1ALDH1A1HPGDSMN1; SMN2LMNA

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-5888723-A SENSITIVE HYBRIDIZATION ASSAY USING NUCLEIC ACID REAGENT COMPOSED OF OLIGONUCLEOTIDES COVALENTLY ATTACHED TO POLYMER PARTICLES WHICH ARE ADHERED TO SUPPORT USING WATER INSOLUBLE ADHESIVE; LOW BACKGROUND JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. (US) 1999-03-30 — — US disclosed
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