SCHEMBL500486

SCHEMBL500486

CC(CN1CCCC1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
CHRM2 P08172 3/20 0.50
ADRA2B P18089 2/20 0.50
DRD3 P35462 2/20 0.50
SIGMAR1 Q99720 2/20 0.50
HRH3 Q9Y5N1 2/20 0.50
LMNA P02545 1/20 0.49
CHRM3 P20309 2/20 0.47
CYP2D6 P10635 1/20 0.47
ADRA2C P18825 1/20 0.47
OPRD1 P41143 1/20 0.47
KCNH2 Q12809 1/20 0.47
CHRM1 P11229 2/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.43
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43
ATM Q13315 2/20 0.42
MITF O75030 1/20 0.42

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
Hydrochloric Acid SCHEMBL5087977 0.98 ALDH1A1 (0.69) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL499912 0.98 ALDH1A1 (0.63) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
Hydrochloric Acid SCHEMBL19815486 0.96 ALDH1A1 (0.67) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL23886134 0.95 ALDH1A1 (0.66) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL23886340 0.95 ALDH1A1 (0.66) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL23886205 0.95 ALDH1A1 (0.66) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL1174390 0.91
SCHEMBL12123730 0.82 CHRM1 (0.56) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL500538 0.81 ALDH1A1 (0.59) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL2536934 0.81 ALDH1A1 (0.59) ALDH1A1CHRM2ADRA2BDRD3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107710462-B Electrochemical hydrogen storage electrode and battery 巴斯夫公司 2022-08-02 CN claimed
EP-3292578-B1 ELECTROCHEMICAL HYDROGEN STORAGE ELECTRODES AND CELLS BASF CORP (US) 2021-02-24 EP claimed
EP-3218955-A1 ELECTROLYTES AND METAL HYDRIDE BATTERIES BASF Corporation (US) 2017-09-20 EP claimed
US-4267362-A Process for the preparation of delta keto-acids and derivatives thereof STAMICARBON, B.V. (NL) 1981-05-12 US claimed
US-20230158179-A1 RADIOPHARMACEUTICAL CONJUGATE COMPOSITIONS AND USES THEREOF RAYZEBIO, INC. 2023-05-25 US disclosed
CN-107710462-B Electrochemical hydrogen storage electrode and battery 巴斯夫公司 2022-08-02 CN disclosed
CN-107615556-B Electrolyte and metal hydride battery 巴斯夫公司 2021-11-02 CN disclosed
EP-3292578-B1 ELECTROCHEMICAL HYDROGEN STORAGE ELECTRODES AND CELLS BASF CORP (US) 2021-02-24 EP disclosed
EP-3292578-A1 ELECTROCHEMICAL HYDROGEN STORAGE ELECTRODES AND CELLS BASF Corporation (US) 2018-03-14 EP disclosed
EP-3275039-A1 ELECTROLYTES AND METAL HYDRIDE BATTERIES BASF Corporation (US) 2018-01-31 EP disclosed
EP-3218955-A1 ELECTROLYTES AND METAL HYDRIDE BATTERIES BASF Corporation (US) 2017-09-20 EP disclosed
US-8105760-B2 Patterning process and pattern surface coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090053657-A1 PATTERNING PROCESS AND PATTERN SURFACE COATING COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-02-26 US disclosed
WO-2007147222-A9 NOVEL IONIC LIQUIDS UNIV LEUVEN KATH (BE) 2008-02-14 WO disclosed
WO-2007147222-A2 NOVEL IONIC LIQUIDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2007-12-27 WO 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-20230158179-A1 RADIOPHARMACEUTICAL CONJUGATE COMPOSITIONS AND USES THEREOF PAICS, LNPEP, DNPEP ALDH1A1 3285/4885CHRM2 4416/4885ADRA2B 4283/4885

“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.