SCHEMBL8524349

SCHEMBL8524349

CN1C(=O)CCc2cc(-c3csc(-c4ccncc4)n3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 3/20 0.59
CDC25B P30305 3/20 0.59
CDC25C P30307 3/20 0.59
DUSP3 P51452 3/20 0.59
CYP11B1 P15538 7/20 0.55
CYP11B2 P19099 7/20 0.55
CYP19A1 P11511 4/20 0.55
CYP1A2 P05177 2/20 0.55
CYP17A1 P05093 1/20 0.55
TRIM24 O15164 1/20 0.55
KDM4E B2RXH2 4/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 1/20 0.49
LMNA P02545 2/20 0.46
AR P10275 1/20 0.46
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45

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
SCHEMBL8636852 0.93 CDC25A (0.57) CDC25ACDC25BCDC25CDUSP3CYP11B1
SCHEMBL8486372 0.89 CDC25A (0.72) CDC25ACDC25BCDC25CDUSP3CYP19A1
SCHEMBL8524322 0.83 CDC25A (0.49) CDC25ACDC25BCDC25CDUSP3CYP11B1
SCHEMBL10658316 0.83 TRIM24 (0.60) CDC25ACDC25BCDC25CDUSP3CYP11B1
Hydrochloric Acid SCHEMBL8525221 0.81 TRIM24 (0.58) CDC25ACDC25BCDC25CDUSP3CYP11B1
SCHEMBL8483334 0.81 CDC25A (0.50) CDC25ACDC25BCDC25CDUSP3CYP19A1
SCHEMBL8524057 0.81 CDC25A (0.47) CDC25ACDC25BCDC25CDUSP3CYP11B1
SCHEMBL8525097 0.80 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3CYP19A1
SCHEMBL8525405 0.80 CDC25A (0.51) CDC25ACDC25BCDC25CDUSP3CYP11B1
Hydrochloric Acid SCHEMBL8524044 0.79 RAB9A (0.55) CDC25ACDC25BCDC25CDUSP3CYP11B1

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
WO-1999015524-A1 THIAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-04-01 WO disclosed