SCHEMBL10654697

SCHEMBL10654697

CCCN(C=O)Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.35
LTA4H P09960 3/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
LMNA P02545 3/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
FDPS P14324 1/20 0.34
ALOX5 P09917 1/20 0.33
BCHE P06276 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL10653357 0.89 MAPT (0.41) LTA4HLMNAMAPTFDPSBCHE
SCHEMBL27824326 0.86 KCNH2 (0.41) LTA4HLMNAMAPTALDH1A1HTT
SCHEMBL10656175 0.85 L3MBTL1 (0.43) L3MBTL1LTA4HALOX15LMNAMAPT
SCHEMBL1416062 0.81 KMT2A (0.34) L3MBTL1LTA4HALOX15LMNATSHR
SCHEMBL10655415 0.81 HPGD (0.35) L3MBTL1LMNAALDH1A1
SCHEMBL4528090 0.80 ALOX5 (0.44) ALOX5BCHE
SCHEMBL1416171 0.77 KMT2A (0.33) L3MBTL1LTA4HALOX15LMNATSHR
SCHEMBL10656155 0.76 LMNA (0.35) LMNAMAPTHSD17B10ALDH1A1
SCHEMBL27727484 0.76 PPARA (0.41) LTA4HALOX15MAPTALDH1A1
SCHEMBL26130465 0.75 ALOX5 (0.40) TSHRALOX5BCHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0177740-B1 ACYLATED SACCHARINE DERIVATIVES BAYER AG (DE) 1988-09-28 EP claimed
US-4713389-A Fungicidally and bactericidally active acylated saccharin derivatives BAYER AKTIENGESELLSCHAFT (DE) 1987-12-15 US claimed
EP-0177740-A1 Acylated saccharine derivatives BAYER AG (DE) 1986-04-16 EP claimed
EP-0177740-B1 ACYLATED SACCHARINE DERIVATIVES BAYER AG (DE) 1988-09-28 EP disclosed
US-4713389-A Fungicidally and bactericidally active acylated saccharin derivatives BAYER AKTIENGESELLSCHAFT (DE) 1987-12-15 US disclosed
EP-0177740-A1 Acylated saccharine derivatives BAYER AG (DE) 1986-04-16 EP disclosed