SCHEMBL6143073

SCHEMBL6143073

C=CCC1(O)CCN(C(=O)OC(C)(C)C)CC1C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX2 P34913 1/20 0.34
HSD11B1 P28845 3/20 0.34
PDE4B Q07343 1/20 0.34
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX1 P07099 1/20 0.33
KRAS P01116 1/20 0.33
PKM P14618 1/20 0.32

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
SCHEMBL5225382 0.88 MEN1 (0.39) NR1H2ALDH1A1MEN1MAPTKMT2A
SCHEMBL25272726 0.77 PDE4B (0.41) NR1H2ALDH1A1MEN1MAPTKMT2A
SCHEMBL22004731 0.77 EPHX2 (0.40) NR1H2ALDH1A1MEN1MAPTKMT2A
SCHEMBL1224512 0.74 USP2 (0.45) NR1H2EPHX2USP2SMN1; SMN2EPHX1
SCHEMBL2604310 0.73 PKM (0.46) EPHX2USP2SMN1; SMN2EPHX1PKM
SCHEMBL3654641 0.72 NR1H2 (0.37) NR1H2ALDH1A1MEN1MAPTKMT2A
SCHEMBL17763768 0.72 USP2 (0.40) NR1H2EPHX2USP2SMN1; SMN2
SCHEMBL31511515 0.72 USP2 (0.45) NR1H2ALDH1A1MAPTEPHX2USP2
SCHEMBL3493196 0.71 USP2 (0.39) ALDH1A1EPHX2USP2SMN1; SMN2EPHX1
SCHEMBL2473165 0.71 PKM (0.42) EPHX2USP2SMN1; SMN2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6841562-B2 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor AVENTIS PHARMA S.A. (FR) 2005-01-11 US disclosed
US-6815547-B2 ANTIMICROBIAL AGENTS EFFECTIVE AGAINST STAPHYLOCOCCUS, STREPTOCOCCUS, ENTEROCOCCUS AVENTIS PHARMA S.A. (FR) 2004-11-09 US disclosed
US-20040082610-A1 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor NOVEXEL (FR) 2004-04-29 US disclosed
US-20030171369-A1 Quinolylpropylpiperidine derivatives, their preparation, and compositions containing them AVENTIS PHARMA S.A. 2003-09-11 US disclosed
US-6602884-B2 Useful as antibiotics against Staphylococcus, Streptococcus, Enterococcus and Moraxella AVENTIS PHARMA S.A. (FR) 2003-08-05 US disclosed
US-20020177606-A1 Quinolylpropylpiperidine derivatives, their preparation, and compositions containing them NOVEXEL (FR) 2002-11-28 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-20020177606-A1 Quinolylpropylpiperidine derivatives, their preparation, and compositions containing them QDPR, MRPL21, RPLP2 NR1H2 2368/4885ALDH1A1 1808/4885MEN1 2329/4885
US-20030171369-A1 Quinolylpropylpiperidine derivatives, their preparation, and compositions containing them QDPR, MRPL21, RPLP2 NR1H2 2368/4885ALDH1A1 1808/4885MEN1 2329/4885
US-20040082610-A1 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor RRS1, MRPL21, FARSB NR1H2 152/4885ALDH1A1 1452/4885MEN1 4058/4885

“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.