SCHEMBL27085090

SCHEMBL27085090

CC(=O)NCCc1c[nH]c2cccc(OC3OC(C)C(O)C(O)C3O)c12

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 3/20 0.62
▸ MTNR1B P49286 3/20 0.62
▸ SLC5A2 P31639 16/20 0.52
▸ SLC5A1 P13866 10/20 0.52
▸ MEN1 O00255 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NQO2 P16083 1/20 0.46

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
SCHEMBL27085180 0.90 SLC5A2 (0.66) MTNR1AMTNR1BSLC5A2SLC5A1
SCHEMBL27084926 0.85 MTNR1A (0.62) MTNR1AMTNR1BMEN1LMNACYP1A2
SCHEMBL30630312 0.85 MTNR1A (0.62) MTNR1AMTNR1BMEN1LMNACYP1A2
SCHEMBL27084669 0.82 HTR6 (0.58) SLC5A2SLC5A1
SCHEMBL27085121 0.80 SLC5A2 (0.55) SLC5A2SLC5A1
SCHEMBL27084728 0.80 HTR2A (0.54) SLC5A2SLC5A1
SCHEMBL27084686 0.80 SLC5A2 (0.53) SLC5A2SLC5A1
SCHEMBL27085009 0.80 SLC5A2 (0.54) SLC5A2SLC5A1
SCHEMBL27085022 0.80 SLC5A2 (0.56) SLC5A2SLC5A1
SCHEMBL29112608 0.79 SLC5A2 (0.52) SLC5A2SLC5A1

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 1 patent. 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

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 MTNR1A 40/4885MTNR1B 89/4885SLC5A2 3921/4885

“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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