SCHEMBL8486184

SCHEMBL8486184

CC(=O)N1CCc2cc(-c3csc(-c4ccncc4)n3)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 9/20 0.56
CYP11B2 P19099 9/20 0.56
RAB9A P51151 8/20 0.56
NPC1 O15118 7/20 0.56
MAPT P10636 6/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
ALDH1A1 P00352 5/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
USP2 O75604 1/20 0.56
HPGD P15428 1/20 0.56
ALOX15 P16050 1/20 0.56
HSD17B10 Q99714 1/20 0.56
CASP3 P42574 1/20 0.55
CASP2 P42575 1/20 0.55
CDC25A P30304 2/20 0.53
CDC25B P30305 2/20 0.53
CDC25C P30307 2/20 0.53

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
SCHEMBL9095738 0.84 CASP3 (0.76) CYP11B1CYP11B2RAB9ANPC1MAPT
SCHEMBL4533562 0.83 CYP11B2 (0.72) CYP11B1CYP11B2
SCHEMBL19625379 0.81 RAB9A (0.63) CYP11B1CYP11B2RAB9ANPC1MAPT
SCHEMBL8486353 0.80 CDC25A (0.79) CYP11B1CYP11B2RAB9ANPC1MAPT
SCHEMBL9094664 0.79 CASP3 (0.54) CYP11B1CYP11B2RAB9ANPC1MAPT
SCHEMBL6197398 0.79 CDC25A (0.49) CYP11B1CYP11B2RAB9ANPC1MAPT
SCHEMBL8524349 0.78 CDC25A (0.59) CYP11B1CYP11B2RAB9ANPC1SMN1; SMN2
SCHEMBL8483334 0.78 CDC25A (0.50) RAB9ANPC1MAPTSMN1; SMN2ALDH1A1
SCHEMBL18114135 0.77 RAB9A (0.67) CYP11B1CYP11B2RAB9ANPC1MAPT
SCHEMBL3609848 0.77 RAB9A (0.59) RAB9ANPC1MAPTSMN1; SMN2ALDH1A1

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