SCHEMBL8289514

SCHEMBL8289514

CCCCCC(=O)Nc1sc2c(c1C(N)=O)CCC(C)C2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AIP O00170 1/20 0.69
SGTA O43765 1/20 0.69
TOMM70 O94826 1/20 0.69
STIP1 P31948 1/20 0.69
PPP5C P53041 1/20 0.69
DNAJC7 Q99615 1/20 0.69
STUB1 Q9UNE7 1/20 0.69
MAPT P10636 10/20 0.69
RXFP1 Q9HBX9 1/20 0.68
POLB P06746 2/20 0.66
ALDH1A1 P00352 6/20 0.65
RAB9A P51151 3/20 0.65
DUSP3 P51452 1/20 0.65
PTPN5 P54829 1/20 0.65
PTPN11 Q06124 1/20 0.65
MEN1 O00255 1/20 0.65
MAPK10 P53779 1/20 0.65
KMT2A Q03164 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
NPC1 O15118 2/20 0.60

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
SCHEMBL8289505 0.99 AIP (0.68) AIPSGTATOMM70STIP1PPP5C
SCHEMBL13574989 0.89 MAPT (0.72) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8288668 0.88 MAPT (0.71) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8289822 0.86 MAPT (0.68) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8290418 0.84 MAPT (0.65) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8290636 0.83 MAPT (0.64) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8290420 0.83 POLB (0.65) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8289709 0.83 MAPT (0.69) AIPSGTATOMM70STIP1PPP5C
SCHEMBL3125764 0.82 ALDH1A1 (0.88) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8288672 0.82 ALDH1A1 (0.93) AIPSGTATOMM70STIP1PPP5C

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-2005033102-A2 THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORPORATION (US) 2005-04-14 WO disclosed