SCHEMBL6160692

SCHEMBL6160692

CCOC(=O)CC(=O)[C@@H]1C[C@@H]1C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.44
▸ MGAM O43451 1/20 0.44
▸ SI P14410 1/20 0.44
▸ MGAM2 Q2M2H8 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ NFKB1 P19838 2/20 0.36
▸ NFKB2 Q00653 2/20 0.36
▸ RELA Q04206 2/20 0.36
▸ EPHX2 P34913 2/20 0.35
▸ TRPA1 O75762 1/20 0.33
▸ CTSL P07711 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ MAPT P10636 1/20 0.31

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
SCHEMBL6160688 1.00 GAA (0.44) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL12994212 0.83 ALDH1A1 (0.42) GAAALDH1A1MEN1TSHRKMT2A
SCHEMBL22051227 0.80 GAA (0.40) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL30354284 0.80 GAA (0.40) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL6890585 0.79 ALDH1A1 (0.45) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL1021895 0.79 ALDH1A1 (0.45) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL12994217 0.79 MAPK1 (0.34) ALDH1A1MEN1TSHRKMT2ANFKB1
SCHEMBL3148606 0.76 MAPK1 (0.41) MEN1KMT2ANFKB1NFKB2RELA
SCHEMBL1298054 0.76 MAPK1 (0.41) MEN1KMT2ANFKB1NFKB2RELA
SCHEMBL21818702 0.74 GAA (0.52) GAAMGAMSIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949662-B2 Cis-substituted aminocyclopropane derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-27 — — US disclosed
EP-0919553-B1 cis-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-03-02 — — EP disclosed
US-20020183523-A1 Cis-substituted aminocyclopropane derivative DAIICHI PHARMACEUTICAL CO., LTD 2002-12-05 — — US disclosed
US-6462040-B1 MICROBIOCIDES; BACTERIOCIDES; ANTIPROTOZOA AGENTS; QUINOLONE ANTIBIOTICS; SIDE EFFECT REDUCTION; ANTIBIOTIC-RESISTANT BACTERIA INCLUDING STAPHYLOCCOCUS; VETERINARY MEDICINE DAIICHO PHARMACEUTICAL CO., LTD. (JP) 2002-10-08 — — US disclosed
US-6391889-B2 POTENT ANTIMICROBIAL ACTIVITY ON BROAD RANGE OF MICROORGANISMS, E.G., STAPHYLOCOCCUS, GRAMPOSITIVE BACTERIA AND QUINOLONE ANTIBIOTIC RESISTANCE; SIDE EFFECT REDUCTION; NONTOXIC DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-05-21 — — US disclosed
US-20020052502-A1 Cis-substituted aminocyclopropane derivative DAIICHI PHARMACEUTICAL CO., LTD. 2002-05-02 — — US disclosed
US-20020002182-A1 CIS-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 — — US disclosed
EP-0919553-A1 cis-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-06-02 — — EP 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-20020052502-A1 Cis-substituted aminocyclopropane derivative SLC11A2, MYD88, ARG1 GAA 2679/4885MGAM 406/4885SI 1668/4885
US-20020002182-A1 CIS-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES PHOSPHO1, CCR2, ECH1 GAA 4494/4885MGAM 720/4885SI 1507/4885
US-20020183523-A1 Cis-substituted aminocyclopropane derivative SLC11A2, MYD88, ARG1 GAA 2679/4885MGAM 406/4885SI 1668/4885

“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.

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