SCHEMBL14279165

SCHEMBL14279165

O=C(NC(CCS)C(=O)NCc1ccco1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ TDP1 Q9NUW8 2/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ RECQL P46063 2/20 0.48
▸ POLB P06746 2/20 0.48
▸ ESR2 Q92731 1/20 0.48
▸ CTDSP1 Q9GZU7 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ TSHR P16473 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ TP53 P04637 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MLYCD O95822 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ KMT2A Q03164 2/20 0.46

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
SCHEMBL14279166 0.83 KDM1A (0.56) TP53KMT2A
SCHEMBL2245712 0.82 ADAMTS5 (0.56) HPGDALDH1A1LMNATDP1NPSR1
SCHEMBL14279161 0.80 HPGD (0.61) HPGDALDH1A1LMNANPSR1POLB
SCHEMBL1490952 0.78 HPGD (0.76) HPGDALDH1A1LMNATDP1NPSR1
SCHEMBL14264750 0.78 ALDH1A1 (0.57) HPGDALDH1A1LMNATDP1RECQL
SCHEMBL5804331 0.76 ALDH1A1 (0.51) HPGDALDH1A1TDP1POLBL3MBTL1
SCHEMBL2330374 0.75 CTRB1 (0.51) HPGDTDP1
SCHEMBL2330376 0.75 CTRB1 (0.51) HPGDTDP1
SCHEMBL2330371 0.75 CTRB1 (0.51) HPGDTDP1
SCHEMBL14279164 0.75 KMT2A (0.54) HPGDALDH1A1LMNATDP1NPSR1

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
US-7320755-B2 Method of preparing ligands for hydrophobic interaction chromatography GE HEALTHCARE BIO-SCIENCES AB (SE) 2008-01-22 — — US disclosed
US-7320755-B2 Method of preparing ligands for hydrophobic interaction chromatography GE HEALTHCARE BIO-SCIENCES AB (SE) 2008-01-22 — — US disclosed
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