SCHEMBL10162333

SCHEMBL10162333

CC(=O)c1ccc(CNC(=O)c2cc(C(=O)NCc3ccc(F)c(F)c3)nc3ccnn23)s1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 5/20 0.41
CACNA1G O43497 4/20 0.41
CACNA1H O95180 4/20 0.41
CACNA1I Q9P0X4 4/20 0.41
MAPK1 P28482 1/20 0.40
PDGFRA P16234 1/20 0.40
MMP13 P45452 3/20 0.39
MAOB P27338 1/20 0.39
SCD O00767 1/20 0.39
PPARG P37231 1/20 0.38
EPHX2 P34913 1/20 0.38
MET P08581 1/20 0.38
CHRM4 P08173 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
SCHEMBL10162336 0.93 MMP13 (0.49) PDPK1MAPK1MMP13EPHX2
SCHEMBL10162345 0.92 MAPK1 (0.43) MAPK1MMP13
SCHEMBL10162346 0.91 MMP13 (0.44) PDPK1MMP13EPHX2
SCHEMBL10162361 0.91 AKT3 (0.43) MAPK1
SCHEMBL10162369 0.89 RIPK1 (0.44) PDPK1MMP13EPHX2
SCHEMBL10162358 0.89 EPHX2 (0.36) PDPK1MAPK1PDGFRAMMP13EPHX2
SCHEMBL10162500 0.88 MMP13 (0.40) PDPK1CACNA1GCACNA1HCACNA1IMAPK1
SCHEMBL10162359 0.88 MMP13 (0.47) PDPK1CACNA1GCACNA1HCACNA1IMAPK1
SCHEMBL10165651 0.87 MMP13 (0.46) CACNA1GCACNA1HCACNA1IMAPK1PDGFRA
SCHEMBL10162460 0.86 MMP13 (0.45) CACNA1GCACNA1HCACNA1IPDGFRAMMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835441-B2 Heterobicyclic metalloprotease inhibitors AMGEN INC. (US) 2014-09-16 US disclosed
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2012-01-19 US disclosed
US-7795245-B2 Heterobicyclic metalloprotease inhibitors Atlantos Pharmaceuticals Holding, Inc. (US) 2010-09-14 US disclosed
US-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2009-12-17 US disclosed
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2009-05-28 US disclosed
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 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 (4 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-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors MMP13, TIMP3, MMP3 PDPK1 2525/4885CACNA1G 2170/4885CACNA1H 2465/4885
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS MMP13, TIMP3, MMP3 PDPK1 2525/4885CACNA1G 2170/4885CACNA1H 2465/4885
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 PDPK1 2525/4885CACNA1G 2170/4885CACNA1H 2465/4885
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 PDPK1 2525/4885CACNA1G 2170/4885CACNA1H 2465/4885

“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.