SCHEMBL12366270

SCHEMBL12366270

Cc1c(C(=O)Nc2ccc(-c3ccc(C(=O)N[C@H](C=O)CCC=O)cc3)cc2)oc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.52
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
HPGD P15428 3/20 0.49
MMP2 P08253 2/20 0.49
MMP13 P45452 2/20 0.49
KDM4E B2RXH2 2/20 0.49
USP2 O75604 2/20 0.49
HSD17B10 Q99714 2/20 0.49
PPARG P37231 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NR2E3 Q9Y5X4 1/20 0.49
NCOR2 Q9Y618 1/20 0.49
KMT2A Q03164 6/20 0.47
NPC1 O15118 6/20 0.47
RAB9A P51151 5/20 0.47
MEN1 O00255 5/20 0.47
TP53 P04637 4/20 0.47
TSHR P16473 3/20 0.47

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
SCHEMBL2242565 0.79 MMP2 (0.54) HCRTR1LMNAMAPK1HTTHPGD
SCHEMBL12367201 0.78 SMN1; SMN2 (0.47) MAPK1HTTHPGDKDM4EHSD17B10
SCHEMBL12366266 0.76 NPC1 (0.52) LMNAHTTKMT2ANPC1RAB9A
SCHEMBL30067718 0.75 NPC1 (0.47) HCRTR1LMNAMAPK1HTTNPC1
SCHEMBL2247310 0.74 HCRTR1 (0.47) HCRTR1LMNAMAPK1HTTHPGD
SCHEMBL2247321 0.73 MMP2 (0.59) HCRTR1LMNAMAPK1HTTHPGD
SCHEMBL13821939 0.72 PTPN1 (0.57) LMNAHTTKDM4ENCOR2KMT2A
SCHEMBL5866924 0.72 LMNA (0.79) HCRTR1LMNAMAPK1HTTHPGD
SCHEMBL24841444 0.71 NPC1 (0.45) HCRTR1LMNAMAPK1HTTNPC1
SCHEMBL12367202 0.71 KMT2A (0.71) LMNAHTTHPGDKDM4EKMT2A

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
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

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 HCRTR1 1532/4885LMNA 4015/4885MAPK1 3853/4885

“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.