SCHEMBL12367201

SCHEMBL12367201

CC(=O)Nc1ccc(-c2ccc(C(=O)N[C@H](C=O)CCC=O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
ALDH1A1 P00352 5/20 0.43
POLB P06746 3/20 0.43
MAPT P10636 2/20 0.43
HDAC1 Q13547 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TP53 P04637 1/20 0.40
HIF1A Q16665 1/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC2 Q92769 1/20 0.40
NFKB1 P19838 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL12366266 0.83 NPC1 (0.52) SMN1; SMN2HTTALDH1A1MEN1KMT2A
SCHEMBL13776492 0.81 RAB9A (0.45) SMN1; SMN2L3MBTL1MAPTMEN1KMT2A
SCHEMBL13776496 0.78 MPO (0.44) SMN1; SMN2HTTALDH1A1MAPTMEN1
SCHEMBL12366270 0.78 HCRTR1 (0.52) SMN1; SMN2HTTL3MBTL1ALDH1A1POLB
SCHEMBL12366696 0.77 KMT2A (0.48) SMN1; SMN2HTTALDH1A1POLBMAPT
SCHEMBL12366684 0.77 NPC1 (0.43) SMN1; SMN2HTTALDH1A1POLBMAPT
SCHEMBL29351366 0.77 CASP3 (0.40) SMN1; SMN2HTTPOLBMEN1KMT2A
SCHEMBL13776441 0.77 CAPN1 (0.49) SMN1; SMN2HTTALDH1A1MEN1KMT2A
SCHEMBL13821939 0.77 PTPN1 (0.57) SMN1; SMN2HTTCACNA1BAPBA1ALDH1A1
SCHEMBL12367202 0.75 KMT2A (0.71) SMN1; SMN2HTTCACNA1BAPBA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7998965-B2 Glutamate aggrecanase inhibitors WYETH LLC (US) 2011-08-16 US disclosed
US-20100010012-A1 GLUTAMATE AGGRECANASE INHIBITORS WYETH (US) 2010-01-14 US disclosed
US-7553873-B2 Glutamate aggrecanase inhibitors WYETH (US) 2009-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100010012-A1 GLUTAMATE AGGRECANASE INHIBITORS ADAMTS5, ADAMTS1, ADAMTS7 SMN1; SMN2 2624/4885HTT 762/4885L3MBTL1 4308/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.