SCHEMBL2176595

SCHEMBL2176595

O=C(Oc1ccc(N2CCCC2)cc1)N1CCCC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.76
POLB P06746 1/20 0.76
KMT2A Q03164 6/20 0.61
SMN1; SMN2 Q16637 6/20 0.61
MEN1 O00255 5/20 0.61
LMNA P02545 2/20 0.61
NPSR1 Q6W5P4 1/20 0.61
NPC1 O15118 3/20 0.59
MAPT P10636 3/20 0.59
HTT P42858 2/20 0.59
RAB9A P51151 2/20 0.59
ALOX15 P16050 1/20 0.59
MAOB P27338 2/20 0.57
TSHR P16473 3/20 0.55
CYP3A4 P08684 3/20 0.55
TP53 P04637 1/20 0.55
MAPK1 P28482 1/20 0.55
MITF O75030 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.53
CYP1A2 P05177 2/20 0.53

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
SCHEMBL5648319 0.98 ALDH1A1 (0.79) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL5648923 0.98 ALDH1A1 (0.79) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL2419713 0.90 CYP1A2 (0.68) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL5650663 0.89 CYP1A2 (0.66) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL15535616 0.81 CYP1A2 (0.54) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL31164264 0.81 ALOX15 (0.62) ALDH1A1POLBKMT2ASMN1; SMN2LMNA
SCHEMBL8747161 0.80 ALDH1A1 (0.79) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL5648810 0.80 ALDH1A1 (0.72) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL25224294 0.80 ALDH1A1 (0.79) ALDH1A1POLBKMT2ASMN1; SMN2MEN1
SCHEMBL22031548 0.80 ALDH1A1 (0.79) ALDH1A1POLBKMT2ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853243-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2014-10-07 US disclosed
US-20110224189-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES INCYTE CORPORATION 2011-09-15 US disclosed
US-7973041-B2 Antiarthritic agents; psoriasis; anticancer agents;antiallergens; metalloprotease inhibitors. INCYTE CORPORATION (US) 2011-07-05 US disclosed
EP-2264030-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases Incyte Corporation (US) 2010-12-22 EP disclosed
US-7491724-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2009-02-17 US disclosed
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases LNCYTE CORPORATION (US) 2008-07-10 US disclosed
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION 2005-05-26 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 (3 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-20110224189-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES MMP25, MMP14, MMP9 ALDH1A1 673/4885POLB 1594/4885KMT2A 1912/4885
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases MMP25, MMP9, MMP24 ALDH1A1 415/4885POLB 2157/4885KMT2A 2227/4885
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases MMP25, MMP2, MMP14 ALDH1A1 497/4885POLB 1479/4885KMT2A 1880/4885

“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.