SCHEMBL28696239

SCHEMBL28696239

Cc1ccc(NC(=O)Nc2ccc(NS(=O)(=O)Cc3ccccc3)cc2NC(=O)Nc2ccc(C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.51
CXCR2 P25025 1/20 0.49
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NAMPT P43490 2/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ALDH1A1 P00352 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
HDAC1 Q13547 1/20 0.45
CYP19A1 P11511 1/20 0.44
PGR P06401 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
SCHEMBL29448250 1.00 HPGD (0.51) HPGDCXCR2RAB9ANPC1SMN1; SMN2
SCHEMBL29448253 0.93 NAMPT (0.54) HPGDNPC1SMN1; SMN2NAMPTALOX15
SCHEMBL28705140 0.93 NAMPT (0.54) HPGDNPC1SMN1; SMN2NAMPTALOX15
SCHEMBL29448260 0.88 HPGD (0.69) HPGDRAB9ANPC1SMN1; SMN2NAMPT
SCHEMBL28696250 0.88 HPGD (0.69) HPGDRAB9ANPC1SMN1; SMN2NAMPT
SCHEMBL28712008 0.87 ALDH1A1 (0.53) RAB9ANPC1SMN1; SMN2NAMPTALDH1A1
SCHEMBL29448247 0.87 ALDH1A1 (0.53) RAB9ANPC1SMN1; SMN2NAMPTALDH1A1
SCHEMBL28700258 0.86 PGR (0.64) HPGDNAMPTKMT2AMEN1MAPT
SCHEMBL29448245 0.85 NAMPT (0.51) HPGDRAB9ANPC1SMN1; SMN2NAMPT
SCHEMBL28935236 0.85 NAMPT (0.51) HPGDRAB9ANPC1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110267939-B Thermosensitive recording material 奥古斯特科勒纸厂欧洲公司 2022-03-15 CN disclosed