SCHEMBL24340317

SCHEMBL24340317

CC(C)N(C)CCc1c[nH]c2cccc(OC(=O)CCCC(=O)O)c12

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 11/20 0.57
▸ HTR2C P28335 4/20 0.49
▸ HTR2B P41595 4/20 0.49
▸ HTR1A P08908 3/20 0.49
▸ HTR6 P50406 2/20 0.49
▸ HTR1B P28222 2/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ HTR1D P28221 1/20 0.43
▸ HTR1E P28566 1/20 0.43
▸ ADORA2A P29274 1/20 0.43
▸ ADORA2B P29275 1/20 0.43
▸ HTR7 P34969 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ HTR5A P47898 1/20 0.43
▸ MTNR1A P48039 1/20 0.43
▸ MTNR1B P49286 1/20 0.43
▸ HTR1F P30939 1/20 0.40
▸ SLC6A4 P31645 1/20 0.39

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
SCHEMBL27084998 0.98 HTR2A (0.59) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL27084806 0.94 HTR2A (0.54) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL25425515 0.91 HTR2A (0.55) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL24168355 0.91 HTR2A (0.55) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL24168730 0.90 HTR2A (0.68) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL30630389 0.90 HTR2A (0.68) HTR2AHTR2CHTR2BHTR1AHTR6
Hydrochloric Acid SCHEMBL30498783 0.90 HTR2A (0.55) HTR2AHTR2CHTR2BHTR1AHTR6
Methyl Alcohol SCHEMBL25423744 0.90 HTR2A (0.55) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL27085247 0.89 HTR2A (0.52) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL24168863 0.89 HTR2A (0.56) HTR2AHTR2CHTR2BHTR1AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043382-A1 MODIFIED INDOLE ALKALOIDS FOR THERAPEUTIC USES COMPASS PATHFINDER LIMITED (GB) 2024-02-08 — — US disclosed
CN-117120415-A Modified indole alkaloids for therapeutic use 指南针探路者有限公司 2023-11-24 — — CN disclosed
US-20220177427-A1 Tryptamine Prodrugs REUNION NEUROSCIENCE CANADA INC. (CA) 2022-06-09 — — US disclosed
US-11292765-B2 Tryptamine prodrugs FIELD TRIP PSYCHEDELICS INC. (CA) 2022-04-05 — — 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 (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-11292765-B2 Tryptamine prodrugs HTR2A, HTR5A, HTR2C HTR2A 1/4885HTR2C 3/4885HTR2B 8/4885
US-20240043382-A1 MODIFIED INDOLE ALKALOIDS FOR THERAPEUTIC USES INMT, AANAT, HNMT HTR2A 53/4885HTR2C 482/4885HTR2B 514/4885
US-20220177427-A1 Tryptamine Prodrugs HTR2A, HTR5A, HTR2C HTR2A 1/4885HTR2C 3/4885HTR2B 8/4885

“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.

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