SCHEMBL28816403

SCHEMBL28816403

CCOC(=O)c1sc(N)nc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.71
HSD17B10 Q99714 1/20 0.71
MAPT P10636 3/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
KDM4E B2RXH2 2/20 0.62
HSP90AA1 P07900 1/20 0.62
CRHBP P24387 1/20 0.62
CRHR2 Q13324 1/20 0.62
DHODH Q02127 5/20 0.62
HPGD P15428 3/20 0.55
CYP1A2 P05177 2/20 0.52
FBP1 P09467 1/20 0.52
CDC7 O00311 3/20 0.50
DBF4 Q9UBU7 3/20 0.50
NPC1 O15118 2/20 0.49
PKM P14618 1/20 0.49
MAPK1 P28482 1/20 0.49
RAB9A P51151 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL1968897 0.88 MEN1 (0.65) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL11165291 0.86 ALDH1A1 (0.69) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL11160196 0.86 ALDH1A1 (0.76) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL2491226 0.85 MEN1 (0.62) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL11161509 0.84 ALDH1A1 (0.76) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL1417293 0.84 ALDH1A1 (0.76) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL28723241 0.84 ALDH1A1 (0.76) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL330552 0.83 ALDH1A1 (1.00) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL4478832 0.82 CDC7 (0.75) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL2691019 0.81 ALDH1A1 (0.71) ALDH1A1HSD17B10MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113960223-B Ultra-high performance liquid chromatography analysis method of Somalutide 浙江湃肽生物有限公司南京分公司 2022-03-25 CN claimed
CN-113960223-A Ultra-high performance liquid chromatography analysis method of Somalutide 浙江湃肽生物有限公司南京分公司 2022-01-21 CN claimed
CN-113960223-B Ultra-high performance liquid chromatography analysis method of Somalutide 浙江湃肽生物有限公司南京分公司 2022-03-25 CN disclosed
CN-113960223-A Ultra-high performance liquid chromatography analysis method of Somalutide 浙江湃肽生物有限公司南京分公司 2022-01-21 CN disclosed