SCHEMBL4075221

SCHEMBL4075221

CC(C)(C)OC(=O)N1CCCN(C(=O)CNC(=O)OCc2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.57
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
PREP P48147 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HTT P42858 1/20 0.48
BACE1 P56817 1/20 0.47
P2RX7 Q99572 6/20 0.47
GPR119 Q8TDV5 1/20 0.45

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
SCHEMBL3049200 0.97 SIGMAR1 (0.60) SIGMAR1MEN1KMT2APREPHTT
SCHEMBL18751212 0.97 SIGMAR1 (0.60) SIGMAR1MEN1KMT2APREPHTT
SCHEMBL3048960 0.93 SIGMAR1 (0.56) SIGMAR1MEN1KMT2APREPL3MBTL1
SCHEMBL14691386 0.88 SIGMAR1 (0.66) SIGMAR1MEN1KMT2AL3MBTL1HTT
SCHEMBL8750837 0.87 PREP (0.60) SIGMAR1KMT2APREPL3MBTL1HTT
SCHEMBL16847349 0.85 MEN1 (0.57) MEN1KMT2AHTTGPR119
SCHEMBL8253758 0.85 PREP (0.60) MEN1KMT2APREPL3MBTL1HTT
SCHEMBL11263011 0.85 PREP (0.59) SIGMAR1MEN1KMT2APREPL3MBTL1
SCHEMBL7159251 0.85 PREP (0.59) SIGMAR1MEN1KMT2APREPL3MBTL1
SCHEMBL2586953 0.84 L3MBTL1 (0.61) PREPL3MBTL1

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
EP-1605938-B1 Antibacterial derivatives of napthydrin and quinoline GLAXO GROUP LTD (GB) 2009-02-11 EP disclosed
US-20060189601-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-08-24 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-20060189601-A1 Antibacterial agents NQO2, NRDC, IFNG SIGMAR1 1018/4885MEN1 3325/4885KMT2A 4446/4885

“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.