SCHEMBL10165280

SCHEMBL10165280

COC(=O)c1cc(C(=O)OC(C)(C)C)n2ncc(F)c2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
HSD17B10 Q99714 5/20 0.37
HPGD P15428 4/20 0.37
CASP1 P29466 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TSHR P16473 1/20 0.37
GABRA1 P14867 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
GABRA2 P47869 2/20 0.36
GABRA4 P48169 2/20 0.36
GABRA6 Q16445 2/20 0.36
KDM4E B2RXH2 6/20 0.35
LCK P06239 1/20 0.35
GAA P10253 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 2/20 0.33
FPR2 P25090 1/20 0.33

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
SCHEMBL13164206 0.90 GABRG2 (0.36) ALDH1A1HSD17B10HPGDCASP1L3MBTL1
SCHEMBL10164456 0.84 LCK (0.38) ALDH1A1HSD17B10HPGDCASP1L3MBTL1
SCHEMBL8247345 0.84 LCK (0.38) ALDH1A1HSD17B10HPGDCASP1L3MBTL1
SCHEMBL4258587 0.83 KDM4E (0.39) ALDH1A1HSD17B10HPGDCASP1L3MBTL1
SCHEMBL10165279 0.81 ALDH1A1 (0.31) ALDH1A1HSD17B10HPGDCASP1L3MBTL1
SCHEMBL8185729 0.79 KDM4E (0.44) ALDH1A1HSD17B10HPGDCASP1L3MBTL1
SCHEMBL8228393 0.78 KDM4E (0.44) ALDH1A1HSD17B10HPGDCASP1L3MBTL1
SCHEMBL10165293 0.76 GUCY1B2 (0.45) ALDH1A1KMT2AMEN1MAPK1ADAMTS4
SCHEMBL14450647 0.76 GUCY1B2 (0.45) ALDH1A1KMT2AMEN1MAPK1ADAMTS4
SCHEMBL8253403 0.72 MAPK1 (0.44) ALDH1A1HPGDL3MBTL1GABRA1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ALDH1A1 1806/4885HSD17B10 501/4885HPGD 313/4885
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS MMP13, TIMP3, MMP3 ALDH1A1 1806/4885HSD17B10 501/4885HPGD 313/4885
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 ALDH1A1 1806/4885HSD17B10 501/4885HPGD 313/4885
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 ALDH1A1 1806/4885HSD17B10 501/4885HPGD 313/4885

“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.