SCHEMBL7411580

SCHEMBL7411580

CC(C)(C)NC(=O)CC(C(=O)O)c1cccs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 3/20 0.39
NPC1 O15118 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM1A O60341 1/20 0.37
RAB9A P51151 1/20 0.37
CYP2C19 P33261 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37

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
SCHEMBL7605356 1.00 MAPT (0.47) MAPTSMN1; SMN2HTTUSP2ALOX15
SCHEMBL30688429 0.78 POLB (0.49) MAPTSMN1; SMN2POLBGAANPC1
SCHEMBL7407275 0.77 POLB (0.40) MAPTSMN1; SMN2LMNAPOLBNPC1
SCHEMBL7410328 0.77 POLB (0.40) MAPTSMN1; SMN2LMNAPOLBNPC1
SCHEMBL7605352 0.75 POLB (0.39) MAPTSMN1; SMN2LMNAPOLBNPC1
SCHEMBL2071309 0.75 CYP2C19 (0.46) SMN1; SMN2USP2LMNAPOLBNPC1
SCHEMBL4215659 0.73 GLS (0.48) MAPTSMN1; SMN2USP2LMNAPOLB
SCHEMBL27624468 0.73 POLB (0.55) MAPTSMN1; SMN2ALOX15LMNAPOLB
SCHEMBL3942724 0.72 CYP2C19 (0.43) SMN1; SMN2HTTUSP2LMNAPOLB
SCHEMBL11635124 0.72 CYP2C19 (0.46) MAPTSMN1; SMN2LMNAPOLBGAA

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
EP-0937042-A1 HETEROARYL SUCCINAMIDES AND THEIR USE AS METALLOPROTEINASE INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 1999-08-25 EP disclosed
WO-1998017643-A1 HETEROARYL SUCCINAMIDES AND THEIR USE AS METALLOPROTEINASE INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 1998-04-30 WO disclosed