SCHEMBL10163693

SCHEMBL10163693

N#Cc1ccc(F)c(CNC(=O)OCc2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.49
KEAP1 Q14145 2/20 0.46
NFE2L2 Q16236 2/20 0.46
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CTSL P07711 4/20 0.45
CTSS P25774 4/20 0.45
CTSB P07858 2/20 0.45
CTSK P43235 2/20 0.45
PLAU P00749 1/20 0.44
HTT P42858 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42

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
SCHEMBL15873799 0.83 CTSL (0.47) KCNA5KEAP1NFE2L2LMNASMN1; SMN2
SCHEMBL8253919 0.81 KCNA5 (0.52) KCNA5KEAP1NFE2L2LMNASMN1; SMN2
SCHEMBL8253060 0.81 KCNA5 (0.52) KCNA5KEAP1NFE2L2LMNASMN1; SMN2
SCHEMBL27109856 0.81 PLAU (0.60) KEAP1NFE2L2LMNASMN1; SMN2CTSL
SCHEMBL10209834 0.81 RAB9A (0.51) LMNASMN1; SMN2PLAUHDAC3HDAC1
SCHEMBL10165003 0.78 PTGDR2 (0.44) CTSLCTSSCTSBCTSK
SCHEMBL29538262 0.77 CTSS (0.45) CTSSCTSK
Phosphonic Acid SCHEMBL3834906 0.77 PLAU (0.55) KEAP1NFE2L2LMNASMN1; SMN2CTSL
SCHEMBL8254099 0.76 SYK (0.51) KCNA5PLAUHDAC3HDAC1HDAC2
SCHEMBL15873776 0.76 CTSS (0.49) KEAP1NFE2L2LMNASMN1; SMN2CTSL

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 11 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-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-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-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-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
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 KCNA5 3931/4885KEAP1 4112/4885NFE2L2 3022/4885
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS MMP13, TIMP3, MMP3 KCNA5 3931/4885KEAP1 4112/4885NFE2L2 3022/4885
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 KCNA5 3931/4885KEAP1 4112/4885NFE2L2 3022/4885
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 KCNA5 3931/4885KEAP1 4112/4885NFE2L2 3022/4885

“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.