SCHEMBL8367488

SCHEMBL8367488

CCC1COCc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.34
PTGDR2 Q9Y5Y4 2/20 0.34
HRH1 P35367 4/20 0.33
SLC6A2 P23975 4/20 0.33
SLC6A4 P31645 3/20 0.33
HTR2C P28335 2/20 0.33
CYP2D6 P10635 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
SCHEMBL7950524 0.81 MTNR1A (0.33) HTR2APTGDR2HRH1HTR2C
Hydrochloric Acid SCHEMBL29960643 0.80 HTR2A (0.46) HTR2AHRH1SLC6A2SLC6A4HTR2C
Hydrochloric Acid SCHEMBL29960736 0.80 HTR2A (0.47) HTR2AHRH1SLC6A2SLC6A4HTR2C
SCHEMBL19828084 0.79 POLB (0.43) HTR2AHRH1SLC6A2SLC6A4CYP2D6
SCHEMBL29960263 0.79 HTR2A (0.47) HTR2AHRH1SLC6A2SLC6A4HTR2C
SCHEMBL29960735 0.77 MEN1 (0.31) HTR2AHRH1HTR2C
SCHEMBL19852205 0.77 NOTUM (0.33) HTR2APTGDR2HRH1HTR2C
SCHEMBL17061157 0.77 NOTUM (0.33) HTR2APTGDR2HRH1HTR2C
SCHEMBL23843790 0.77 HTR2A (0.44) HTR2AHRH1HTR2C
SCHEMBL8402502 0.76 ADRA2A (0.40) HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295181-A1 INHIBITOR OF APOPTOSIS (IAP) PROTEIN ANTAGONISTS Sanford Burnham Prebys Medical Discovery Institute 2023-09-21 US disclosed
US-20230024302-A1 2,3,5-TRISUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS ARCUS BIOSCIENCES, INC. 2023-01-26 US disclosed
US-20230009608-A1 GRK2 INHIBITORS AND USES THEREOF SONATA THERAPEUTICS, INC. 2023-01-12 US disclosed
CN-115521325-A Boronic acid derivatives 首药控股(北京)股份有限公司 2022-12-27 CN disclosed
US-8283357-B2 Cycloalkylcarbamate benzamide aniline HDAC inhibitor compounds GILEAD SCIENCES, INC. (US) 2012-10-09 US disclosed
US-20100311794-A1 CYCLOALKYLCARBAMATE BENZAMIDE ANILINE HDAC INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2010-12-09 US disclosed
US-20080306136-A1 Substituted Ureas and Carbamates ELAN PHARMACEUTICALS, INC. 2008-12-11 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 (5 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-20230009608-A1 GRK2 INHIBITORS AND USES THEREOF GRK2, GRK3, GRK1 HTR2A 908/4885PTGDR2 476/4885HRH1 2815/4885
US-20230024302-A1 2,3,5-TRISUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS PIK3CA, PIK3CG, PIK3CD HTR2A 3224/4885PTGDR2 1159/4885HRH1 2286/4885
US-20100311794-A1 CYCLOALKYLCARBAMATE BENZAMIDE ANILINE HDAC INHIBITOR COMPOUNDS HDAC1, HDAC5, HDAC3 HTR2A 2778/4885PTGDR2 4567/4885HRH1 552/4885
US-20080306136-A1 Substituted Ureas and Carbamates BACE1, BACE2, APP HTR2A 4634/4885PTGDR2 4303/4885HRH1 958/4885
US-20230295181-A1 INHIBITOR OF APOPTOSIS (IAP) PROTEIN ANTAGONISTS API5, XIAP, BIRC5 HTR2A 4276/4885PTGDR2 4515/4885HRH1 4181/4885

“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.