SCHEMBL24630407

SCHEMBL24630407

CC(C)c1sc(N)nc1C(=O)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ COPS5 Q92905 6/20 0.43
▸ GFER P55789 1/20 0.38
▸ FBP1 P09467 3/20 0.37
▸ TSHR P16473 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ALDH1A1 P00352 5/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ GAA P10253 1/20 0.33
▸ HPGD P15428 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PKM P14618 1/20 0.31

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
SCHEMBL12292842 0.80 COPS5 (0.44) COPS5FBP1ALDH1A1CYP1A2GAA
SCHEMBL353509 0.80 COPS5 (0.58) COPS5FBP1ALDH1A1CYP1A2HPGD
SCHEMBL15652654 0.80 COPS5 (0.44) COPS5FBP1MAPK1ALDH1A1CYP1A2
SCHEMBL17863862 0.79 HCRTR2 (0.41) GFERTSHRMAPK1ALDH1A1HPGD
SCHEMBL1096595 0.76 ALDH1A1 (0.51) COPS5FBP1MAPK1ALDH1A1CYP1A2
SCHEMBL12659982 0.76 PTGS1 (0.32) TSHRMAPK1HPGDSMN1; SMN2NPC1
SCHEMBL13404132 0.76 GFER (0.36) GFERHPGDSMN1; SMN2NPC1LMNA
SCHEMBL2082444 0.72 ALDH1A1 (0.65) COPS5FBP1ALDH1A1CYP1A2GAA
SCHEMBL3197829 0.71 KMT2A (0.43) COPS5ALDH1A1CYP1A2GAAHPGD
SCHEMBL4121073 0.69 FBP1 (0.52) COPS5FBP1ALDH1A1CYP1A2

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-2022150555-A2 METHODS AND COMPOUNDS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. (US) 2022-07-14 — — WO disclosed
Send feedback