SCHEMBL2815054

SCHEMBL2815054

NC(=O)/C=C/c1ccoc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.69
MAPT P10636 4/20 0.54
ALOX5 P09917 3/20 0.54
ALDH1A1 P00352 3/20 0.54
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
KMT2A Q03164 4/20 0.43
POLB P06746 4/20 0.43
MEN1 O00255 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
HTT P42858 1/20 0.43
BLM P54132 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP1A2 P05177 3/20 0.41
CYP2C19 P33261 2/20 0.41
CYP1A1 P04798 1/20 0.41
CYP1B1 Q16678 1/20 0.41

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
SCHEMBL1380933 1.00 HCAR2 (0.69) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL7893859 0.82 HCAR2 (1.00) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL660178 0.82 HCAR2 (1.00) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL564789 0.82 HCAR2 (1.00) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL28981304 0.80 HCAR2 (0.69) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL3513899 0.80 HCAR2 (0.69) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL6832853 0.80 HCAR2 (0.69) HCAR2MAPTALOX5ALDH1A1MAOA
Hydrochloric Acid SCHEMBL9261463 0.80 HCAR2 (0.96) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL13692335 0.80 HCAR2 (0.69) HCAR2MAPTALOX5ALDH1A1MAOA
SCHEMBL14504206 0.78 HCAR2 (0.56) HCAR2MAPTALOX5ALDH1A1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022225045-A1 THERAPEUTIC OR PROPHYLACTIC AGENT FOR CACHEXIA ACCOMPANIED BY GHRELIN RESISTANCE 東レ株式会社 2022-10-27 WO claimed
CN-1217943-C New use and novel N-azabicyclo-amide derivatives ASTRAZENECA AB (SE) 2005-09-07 CN claimed
CN-1423651-A Novel use and novel N-azabicyclo-amide derivatives ASTRAZENECA AB (SE) 2003-06-11 CN claimed
CN-117177772-A Therapeutic or prophylactic agent for cachexia accompanied by ghrelin resistance 东丽株式会社 2023-12-05 CN disclosed
CN-115768430-A Ameliorating or preventing agent for muscle strength decline symptoms in diseases or syndromes accompanied by metabolic disorders 东丽株式会社 2023-03-07 CN disclosed
US-9879021-B2 Compounds as rearranged during transfection (RET) inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-01-30 US disclosed
US-20170298074-A1 NOVEL COMPOUNDS AS REARRANGED DURING TRANSFECTION (RET) INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-19 US disclosed
US-20100247938-A1 MATERIAL FOR THREE-DIMENSIONAL MODELING, PROCESS FOR PRODUCING THREE-DIMENSIONAL MODEL, AND THREE-DIMENSIONAL MODEL FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed
WO-2008109238-A1 SUBSTITUTED CYCLOPENTYL PIPERIDINE CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-12 WO disclosed
CN-1217943-C New use and novel N-azabicyclo-amide derivatives ASTRAZENECA AB (SE) 2005-09-07 CN disclosed
CN-1423651-A Novel use and novel N-azabicyclo-amide derivatives ASTRAZENECA AB (SE) 2003-06-11 CN 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-20170298074-A1 NOVEL COMPOUNDS AS REARRANGED DURING TRANSFECTION (RET) INHIBITORS RET, FER, THRB HCAR2 2357/4885MAPT 1673/4885ALOX5 4045/4885

“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.