SCHEMBL8525207

SCHEMBL8525207

CC(C)N1C(=O)CCC(C)(C)c2cc(-c3csc(-c4ccncc4)n3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 1/20 0.42
CDC25A P30304 3/20 0.41
CDC25B P30305 3/20 0.41
CDC25C P30307 3/20 0.41
DUSP3 P51452 3/20 0.41
CYP19A1 P11511 4/20 0.40
LMNA P02545 2/20 0.39
AR P10275 2/20 0.39
KMT2A Q03164 2/20 0.38
RARA P10276 1/20 0.36
RARB P10826 1/20 0.36
RARG P13631 1/20 0.36
TRIM24 O15164 1/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL8524649 0.90 RARA (0.44) KDM4ESMN1; SMN2RAB9ANPC1CDC25A
SCHEMBL8524544 0.88 CYP19A1 (0.44) KDM4ECDC25ACDC25BCDC25CDUSP3
SCHEMBL8524322 0.87 CDC25A (0.49) KDM4ESMN1; SMN2RAB9ANPC1CDC25A
SCHEMBL8524244 0.87 CDK5 (0.38) KDM4ESMN1; SMN2RAB9ANPC1CYP19A1
SCHEMBL8524782 0.86 CYP19A1 (0.48) SMN1; SMN2RAB9ANPC1CDC25ACDC25B
SCHEMBL8524583 0.86 CDC25A (0.44) KDM4ESMN1; SMN2RAB9ANPC1CDC25A
SCHEMBL8525200 0.84 BACE1 (0.35) KDM4ESMN1; SMN2CDC25ACDC25BCDC25C
SCHEMBL8524156 0.84 CDC25A (0.45) KDM4ESMN1; SMN2RAB9ANPC1CDC25A
SCHEMBL8524913 0.83 CDC25A (0.36) CDC25ACDC25BCDC25CDUSP3
SCHEMBL8524425 0.82 KDM4E (0.44) KDM4ESMN1; SMN2RAB9ANPC1CDC25A

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

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