SCHEMBL8636852

SCHEMBL8636852

CN1C(=O)CCCc2cc(-c3csc(-c4ccncc4)n3)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 4/20 0.57
CDC25B P30305 4/20 0.57
CDC25C P30307 4/20 0.57
DUSP3 P51452 4/20 0.57
TRIM24 O15164 1/20 0.53
BMPR1B O00238 1/20 0.47
BMPR1A P36894 1/20 0.47
TGFBR1 P36897 1/20 0.47
ACVRL1 P37023 1/20 0.47
ACVR1 Q04771 1/20 0.47
CYP19A1 P11511 5/20 0.47
CYP11B1 P15538 4/20 0.47
CYP11B2 P19099 4/20 0.47
CYP1A2 P05177 2/20 0.47
CYP17A1 P05093 1/20 0.47
KDM4E B2RXH2 5/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 2/20 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
SCHEMBL8524349 0.93 CDC25A (0.59) CDC25ACDC25BCDC25CDUSP3TRIM24
SCHEMBL8486372 0.87 CDC25A (0.72) CDC25ACDC25BCDC25CDUSP3TRIM24
SCHEMBL8525405 0.87 CDC25A (0.51) CDC25ACDC25BCDC25CDUSP3TRIM24
SCHEMBL8525097 0.87 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3TRIM24
Hydrochloric Acid SCHEMBL8523582 0.85 CDC25A (0.47) CDC25ACDC25BCDC25CDUSP3TRIM24
Hydrochloric Acid SCHEMBL8524982 0.85 CDC25A (0.49) CDC25ACDC25BCDC25CDUSP3TRIM24
SCHEMBL8525234 0.85 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3TRIM24
SCHEMBL8483711 0.84 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3TRIM24
Hydrochloric Acid SCHEMBL8485430 0.84 CDC25A (0.48) CDC25ACDC25BCDC25CDUSP3TRIM24
Hydrochloric Acid SCHEMBL8524566 0.84 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3TRIM24

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