SCHEMBL6162465

SCHEMBL6162465

CC(C)(C)OC(=O)C1CC1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.43
GRM2 Q14416 2/20 0.41
GABRR1 P24046 5/20 0.37
MAPK1 P28482 2/20 0.37
GABRR2 P28476 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HRH3 Q9Y5N1 1/20 0.33
NR1H2 P55055 1/20 0.33
GRM3 Q14832 1/20 0.33

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
SCHEMBL2500717 1.00 BTK (0.43) BTKGRM2GABRR1MAPK1GABRR2
SCHEMBL1297008 1.00 BTK (0.43) BTKGRM2GABRR1MAPK1GABRR2
SCHEMBL1297399 1.00 BTK (0.43) BTKGRM2GABRR1MAPK1GABRR2
SCHEMBL25245251 1.00 BTK (0.43) BTKGRM2GABRR1MAPK1GABRR2
SCHEMBL1297403 1.00 BTK (0.43) BTKGRM2GABRR1MAPK1GABRR2
SCHEMBL25286574 1.00 BTK (0.43) BTKGRM2GABRR1MAPK1GABRR2
SCHEMBL3148606 0.91 MAPK1 (0.41) BTKMAPK1CHRM2CHRM1CHRM3
SCHEMBL1298054 0.91 MAPK1 (0.41) BTKMAPK1CHRM2CHRM1CHRM3
SCHEMBL1101752 0.90 BTK (0.40) BTKGRM2GABRR1MAPK1GABRR2
SCHEMBL24487912 0.90 BTK (0.40) BTKGRM2GABRR1MAPK1GABRR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4003963-A1 PYRAZOLE DERIVATIVES FOR CONTROLLING ARTHROPODS Bayer Animal Health GmbH (DE) 2022-06-01 EP disclosed
CN-114423740-A Pyrazole derivatives for controlling arthropods 拜耳动物保健有限责任公司 2022-04-29 CN disclosed
CN-101641325-A Ornithine derivative ASTELLAS PHARMA INC JP 2010-02-03 CN disclosed
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
CN-1113064-C Cis-substituted aminocyclopropane derivatives DAIICHI SEIYAKU CO (JP) 2003-07-02 CN 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
CN-1228776-A Cis-substituted aminocyclopropane derivatives DAIICHI SEIYAKU CO (JP) 1999-09-15 CN 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 BTK 1800/4885GRM2 2325/4885GABRR1 2830/4885
US-20020002182-A1 CIS-SUBSTITUTED AMINOCYCLOPROPANE DERIVATIVES PHOSPHO1, CCR2, ECH1 BTK 1576/4885GRM2 1460/4885GABRR1 2853/4885
US-20020183523-A1 Cis-substituted aminocyclopropane derivative SLC11A2, MYD88, ARG1 BTK 1800/4885GRM2 2325/4885GABRR1 2830/4885

“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.