SCHEMBL7958982

SCHEMBL7958982

COc1ccccc1S(=O)(=O)NCc1ccc(N2CCN(c3ccncc3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.60
LMNA P02545 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
NAMPT P43490 1/20 0.48
HTT P42858 3/20 0.48
ALDH1A1 P00352 3/20 0.48
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.45
NR2F2 P24468 1/20 0.44
KMT2A Q03164 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
SCHEMBL7958303 0.85 NR3C2 (0.53) POLBLMNAL3MBTL1SMN1; SMN2HTT
SCHEMBL7956456 0.84 RAB9A (0.49) POLBLMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL7956237 0.80 GAA (0.44) POLBLMNAL3MBTL1SMN1; SMN2NAMPT
SCHEMBL7958990 0.80 ALDH1A1 (0.60) POLBLMNASMN1; SMN2NAMPTHTT
SCHEMBL7956813 0.77 GAA (0.50) POLBLMNAL3MBTL1SMN1; SMN2NAMPT
SCHEMBL5166003 0.76 SMN1; SMN2 (0.60) LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL7956461 0.73 ALDH1A1 (0.54) POLBLMNASMN1; SMN2HTTALDH1A1
SCHEMBL5167263 0.72 SMN1; SMN2 (0.56) LMNAL3MBTL1SMN1; SMN2NAMPTALDH1A1
SCHEMBL5892016 0.72 CYP19A1 (0.57) LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL27083314 0.72 POLB (0.61) POLBLMNAL3MBTL1SMN1; SMN2NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6313127-B1 FOR THERAPY OF HYPERCHOLESTEROLEMIA OR ATHEROSCLEROSIS ZENECA LIMITED (GB) 2001-11-06 US disclosed
EP-0880501-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PHARMACEUTICAL AGENTS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
WO-1997028128-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PHARMACEUTICAL AGENTS ZENECA LIMITED (GB) 1997-08-07 WO disclosed