SCHEMBL28295534

SCHEMBL28295534

CCOC(=O)c1nc(-c2ccc(OC)cc2)sc1C(=O)OCC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.63
TRPM8 Q7Z2W7 4/20 0.60
CDC7 O00311 8/20 0.60
DBF4 Q9UBU7 8/20 0.60
MAPT P10636 3/20 0.57
TARBP2 Q15633 2/20 0.57
PDCD4 Q53EL6 1/20 0.57
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
KDM4E B2RXH2 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 2/20 0.54
RAB9A P51151 2/20 0.54
NPC1 O15118 1/20 0.54
TP53 P04637 1/20 0.54
HPGD P15428 1/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
HSD17B10 Q99714 1/20 0.54

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
SCHEMBL10552788 0.89 TARBP2 (0.57) PTPN11TRPM8CDC7DBF4MAPT
SCHEMBL2085303 0.88 CDC7 (0.73) PTPN11TRPM8CDC7DBF4MAPT
SCHEMBL5194957 0.87 GRM6 (0.58) PTPN11TRPM8CDC7DBF4MAPT
Hydrochloric Acid SCHEMBL11121421 0.84 CDC7 (0.76) TRPM8CDC7DBF4
SCHEMBL29660243 0.84 ALOX5 (0.60) PTPN11TRPM8CDC7DBF4TARBP2
SCHEMBL4801129 0.83 MAPT (0.78) TRPM8CDC7DBF4MAPTGAA
SCHEMBL2883597 0.83 PTPN11 (0.69) PTPN11TRPM8CDC7DBF4MAPT
SCHEMBL13437323 0.83 TARBP2 (0.51) PTPN11TRPM8CDC7DBF4MAPT
SCHEMBL16039074 0.82 CDC7 (0.76) PTPN11TRPM8CDC7DBF4MEN1
SCHEMBL3769955 0.82 PTPN11 (0.58) PTPN11TRPM8CDC7DBF4MAPT

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-109810071-A A kind of miRNA biosynthesis inhibitor 中国科学院成都生物研究所 2019-05-28 CN disclosed