SCHEMBL2173174

SCHEMBL2173174

C[C@]1(C(=O)O)CC(=O)CC[C@@H]1C(=O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
TSHR P16473 4/20 0.47
LMNA P02545 3/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
TFPI2 P48307 1/20 0.45
TP53 P04637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
ADAM10 O14672 2/20 0.44
ERBB2 P04626 2/20 0.44
MMP2 P08253 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 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
SCHEMBL2173774 0.84 LMNA (0.47) KMT2ATSHRLMNAPOLBMAPT
SCHEMBL2173712 0.80 KMT2A (0.49) KMT2ATSHRLMNAPOLBMAPT
SCHEMBL2172833 0.80 KMT2A (0.49) KMT2ATSHRLMNAPOLBMAPT
SCHEMBL2174644 0.76 KMT2A (0.46) KMT2ATSHRLMNAPOLBMAPT
SCHEMBL4465456 0.76 KMT2A (0.46) KMT2ATSHRLMNAPOLBMAPT
SCHEMBL2172058 0.75 KMT2A (0.45) KMT2ATSHRLMNAPOLBMAPT
SCHEMBL16356982 0.73 TDP1 (0.73) KMT2ATSHRMAPTHTTTFPI2
SCHEMBL2176927 0.72 LMNA (0.43) KMT2ATSHRLMNAPOLBMAPT
SCHEMBL3457211 0.70 ADAM10 (0.56) KMT2ATSHRLMNAMAPTTFPI2
SCHEMBL2173170 0.68 ADAM10 (0.54) KMT2ATSHRPOLBMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9440958-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2016-09-13 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
US-7491724-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2009-02-17 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 (2 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 KMT2A 1912/4885TSHR 3573/4885LMNA 2321/4885
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases MMP25, MMP2, MMP14 KMT2A 1880/4885TSHR 3634/4885LMNA 2198/4885

“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.