SCHEMBL8253191

SCHEMBL8253191

CC(C)(C)OC(=O)NCc1ccc(F)c(NC(=O)OCc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
HDAC1 Q13547 3/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC2 Q92769 1/20 0.47
NTSR1 P30989 1/20 0.45
MAPT P10636 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MAPK1 P28482 1/20 0.45
NAMPT P43490 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TACR1 P25103 1/20 0.43
PLAU P00749 1/20 0.43
GLS O94925 1/20 0.43
POLB P06746 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43

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
SCHEMBL8254099 0.86 SYK (0.51) SYKHDAC1MEN1KMT2AHDAC3
SCHEMBL14485285 0.82 SYK (0.62) SYKHDAC1MEN1KMT2AHDAC3
SCHEMBL3940116 0.82 NAMPT (0.60) SYKHDAC1MEN1KMT2ANTSR1
SCHEMBL4304475 0.80 RAB9A (0.53) NPC1RAB9AHDAC1MEN1KMT2A
SCHEMBL10165146 0.79 MEN1 (0.44) SYKHDAC1MEN1KMT2ANTSR1
SCHEMBL13193091 0.78 MGLL (0.51) SYKNPC1RAB9AMEN1KMT2A
SCHEMBL19233183 0.78 NPC1 (0.50) SYKNPC1RAB9AMEN1KMT2A
SCHEMBL15873833 0.78 SYK (0.52) SYKNPC1RAB9AHDAC1MEN1
SCHEMBL19194842 0.77 NPC1 (0.47) SYKNPC1RAB9AHDAC1MAPK1
SCHEMBL24999627 0.77 GRM2 (0.49) HDAC1NAMPTGLS

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-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
WO-2006128184-A2 PYRIMIDINE OR TRIAZINE FUSED BICYCLIC METALLOPROTEASE INHIBITORS ALANTOS-PHARMACEUTICALS, INC. (US) 2006-11-30 WO 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 SYK 4801/4885NPC1 2374/4885RAB9A 1239/4885
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS MMP13, TIMP3, MMP3 SYK 4801/4885NPC1 2374/4885RAB9A 1239/4885
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 SYK 4801/4885NPC1 2374/4885RAB9A 1239/4885
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 SYK 4801/4885NPC1 2374/4885RAB9A 1239/4885

“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.