SCHEMBL1364448

SCHEMBL1364448

CN1CC2(CC(C(=O)O)C1C(=O)N1CCN(c3ccccc3[N+](=O)[O-])CC1)CC2C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.43
ADAM10 O14672 1/20 0.42
ERBB2 P04626 1/20 0.42
MMP2 P08253 1/20 0.42
MAPT P10636 5/20 0.41
ENPP2 Q13822 4/20 0.40
LMNA P02545 3/20 0.39
KMT2A Q03164 3/20 0.39
HTT P42858 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.39
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
MEN1 O00255 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
FFAR1 O14842 1/20 0.37

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
SCHEMBL1365726 0.87 AR (0.47) ADAM10ERBB2MMP2MAPTLMNA
SCHEMBL1366348 0.85 ADAM10 (0.57) ADAM10ERBB2MMP2MAPTLMNA
SCHEMBL1363633 0.85 ADAM10 (0.44) ADAM10ERBB2MMP2MAPTLMNA
SCHEMBL1367100 0.85 KMT2A (0.55) ADAM10ERBB2MMP2LMNAKMT2A
SCHEMBL1365545 0.83 DRD2 (0.41) ADAM10ERBB2MMP2
SCHEMBL1364105 0.80 PDGFRB (0.45) ADAM10ERBB2MMP2KMT2AALDH1A1
SCHEMBL1366426 0.80 GRM5 (0.46) GRM5ADAM10ERBB2MMP2MAPT
SCHEMBL1366988 0.79 NCF1 (0.52) ADAM10ERBB2MMP2MAPTLMNA
SCHEMBL1365736 0.79 MEN1 (0.47) ADAM10ERBB2MMP2MAPTLMNA
SCHEMBL1365953 0.78 ADAM10 (0.44) ADAM10ERBB2MMP2MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637497-B2 AZA spiro alkane derivatives as inhibitors of metalloproteases INCYTE CORPORATION (US) 2014-01-28 US disclosed
US-20110288068-A1 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLOPROTEASES INCYTE CORPORATION 2011-11-24 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 (1 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-20110288068-A1 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLOPROTEASES MMP9, MMP3, MMP12 GRM5 3397/4885ADAM10 29/4885ERBB2 2841/4885

“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.