SCHEMBL8484367

SCHEMBL8484367

CCC(C)N1C(=O)CCCc2cc(-c3csc(-c4ccncc4)n3)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 4/20 0.48
CDC25B P30305 4/20 0.48
CDC25C P30307 4/20 0.48
DUSP3 P51452 4/20 0.48
RAB9A P51151 5/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
NPC1 O15118 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
TP53 P04637 1/20 0.43
GFER P55789 1/20 0.43
CYP19A1 P11511 4/20 0.41
KDM4E B2RXH2 5/20 0.40
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TRIM24 O15164 1/20 0.39
BMPR1B O00238 1/20 0.38
BMPR1A P36894 1/20 0.38

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
SCHEMBL8525097 0.90 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3RAB9A
SCHEMBL8525405 0.84 CDC25A (0.51) CDC25ACDC25BCDC25CDUSP3RAB9A
SCHEMBL8636852 0.84 CDC25A (0.57) CDC25ACDC25BCDC25CDUSP3RAB9A
SCHEMBL8483711 0.83 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3RAB9A
SCHEMBL8524902 0.81 RAB9A (0.44) CDC25ACDC25BCDC25CDUSP3RAB9A
Hydrochloric Acid SCHEMBL8524829 0.80 CYP19A1 (0.48) CDC25ACDC25BCDC25CDUSP3RAB9A
SCHEMBL8525234 0.80 CDC25A (0.46) CDC25ACDC25BCDC25CDUSP3RAB9A
Hydrochloric Acid SCHEMBL8524982 0.80 CDC25A (0.49) CDC25ACDC25BCDC25CDUSP3RAB9A
Hydrochloric Acid SCHEMBL8525010 0.79 CDC25A (0.43) CDC25ACDC25BCDC25CDUSP3RAB9A
SCHEMBL8480593 0.79 CDC25A (0.43) CDC25ACDC25BCDC25CDUSP3RAB9A

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