SCHEMBL27084673

SCHEMBL27084673

CCCN(CCC)CCc1c[nH]c2c(OC3OC(C)C(O)C(O)C3O)cccc12

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 1/20 0.44
▸ BCHE P06276 2/20 0.43
▸ ACHE P22303 1/20 0.43
▸ SLC5A2 P31639 6/20 0.41
▸ SLC5A1 P13866 5/20 0.41
▸ HTR2A P28223 4/20 0.40
▸ HTR1D P28221 1/20 0.39
▸ ATM Q13315 1/20 0.37
▸ MTNR1A P48039 1/20 0.36
▸ MTNR1B P49286 1/20 0.36

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
SCHEMBL27085168 0.96 HTR2A (0.46) HTR6BCHEACHESLC5A2SLC5A1
SCHEMBL27085103 0.93 HTR6 (0.45) HTR6BCHEACHESLC5A2SLC5A1
SCHEMBL27085003 0.89 SLC5A2 (0.53) HTR6SLC5A2SLC5A1ATM
SCHEMBL27085000 0.89 HTR6 (0.47) HTR6BCHEACHESLC5A2SLC5A1
SCHEMBL27085236 0.89 HTR6 (0.58) HTR6SLC5A2SLC5A1HTR2AATM
SCHEMBL27084930 0.88 HTR6 (0.45) HTR6BCHEACHESLC5A2SLC5A1
SCHEMBL27085218 0.87 HTR6 (0.41) HTR6BCHEACHESLC5A2SLC5A1
SCHEMBL27085174 0.87 HTR6 (0.43) HTR6BCHEACHESLC5A2SLC5A1
SCHEMBL27084990 0.86 HTR6 (0.44) HTR6BCHEACHESLC5A2SLC5A1
SCHEMBL27084830 0.86 SLC5A2 (0.51) SLC5A2SLC5A1HTR2AATM

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-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

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-20240043382-A1 MODIFIED INDOLE ALKALOIDS FOR THERAPEUTIC USES INMT, AANAT, HNMT HTR6 57/4885BCHE 7/4885ACHE 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.

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