SCHEMBL10190393

SCHEMBL10190393

COc1cc(CC(C)C)c(OC)cc1C

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.56
HTR2A P28223 4/20 0.53
HTR1A P08908 1/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47

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
SCHEMBL26782443 0.90 HTR2A (0.50) TAAR1HTR2AHTR1AHTR2CHTR2B
SCHEMBL26053886 0.89 TAAR1 (0.46) TAAR1HTR2AHTR1AHTR2CHTR2B
SCHEMBL10019206 0.88 MAPT (0.49) TAAR1HTR2A
SCHEMBL18867916 0.86 HTR2A (0.50) TAAR1HTR2AHTR1AHTR2CHTR2B
SCHEMBL14113379 0.85 HTR2A (0.70) TAAR1HTR2AHTR1AHTR2CHTR2B
Dom SCHEMBL1742173 0.85 HTR2A (0.76) TAAR1HTR2AHTR1AHTR2CHTR2B
Dom SCHEMBL398119 0.85 HTR2A (0.76) TAAR1HTR2AHTR1AHTR2CHTR2B
Dom SCHEMBL988769 0.83 HTR2A (0.73) TAAR1HTR2AHTR1AHTR2CHTR2B
SCHEMBL18757899 0.83 HTR2A (0.51) TAAR1HTR2A
SCHEMBL5306335 0.82 TAAR1 (0.50) TAAR1HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265045-A1 PHENALKYLAMINES AND METHODS OF TREATING MOOD DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2023-08-24 US disclosed
US-8101661-B2 Polar hydrophilic prodrugs and non-standard amino acid conjugates of amphetamine and other stimulants and processes for making and using the same KEMPHARM, INC. (US) 2012-01-24 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 (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-20230265045-A1 PHENALKYLAMINES AND METHODS OF TREATING MOOD DISORDERS PNMT, HTR2C, HTR2A TAAR1 66/4885HTR2A 3/4885HTR1A 12/4885

“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.