SCHEMBL31411434

SCHEMBL31411434

COc1cc(F)c2[nH]nc(CCN3CCC3)c2c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 2/20 0.44
▸ HRH3 Q9Y5N1 4/20 0.39
▸ ABCC1 P33527 2/20 0.38
▸ SIGMAR1 Q99720 2/20 0.38
▸ HTR1A P08908 3/20 0.37
▸ CYP3A4 P08684 1/20 0.36
▸ PDE10A Q9Y233 2/20 0.36
▸ CFTR P13569 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL31411389 0.98 HTR2A (0.43) HTR2AHRH3ABCC1SIGMAR1HTR1A
SCHEMBL31411404 0.79 CFTR (0.32) HRH3PDE10ACFTRALDH1A1
SCHEMBL31411448 0.76 HTR1A (0.40) HTR2AHRH3SIGMAR1HTR1ACYP3A4
SCHEMBL31411284 0.74 HTR2A (0.41) HTR2AHTR1AALDH1A1
SCHEMBL31411411 0.74 HTR2A (0.37) HTR2ACFTRALDH1A1
SCHEMBL31411422 0.73 HTR1A (0.45) HTR2AHRH3ABCC1SIGMAR1HTR1A
SCHEMBL31651554 0.73 HTR1A (0.42) HTR2AHRH3SIGMAR1HTR1AALDH1A1
Formic Acid SCHEMBL31411275 0.71 HTR2A (0.43) HTR2AHTR1ACFTRL3MBTL1
SCHEMBL31411358 0.71 HTR1A (0.47) HTR2AHRH3ABCC1SIGMAR1HTR1A
SCHEMBL31411446 0.68 TAAR1 (0.36) HTR2APDE10ACFTRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4735425-A1 COMPOUNDS Psylo Pty Ltd (AU) 2026-05-06 — — EP disclosed
US-20250353818-A1 Compounds Psylo Pty Ltd (AU) 2025-11-20 — — US disclosed
US-12428380-B2 Compounds Psylo Pty Ltd (AU) 2025-09-30 — — US disclosed
US-20250214943-A1 Compounds Psylo Pty Ltd (AU) 2025-07-03 — — US disclosed
WO-2025000053-A1 COMPOUNDS Psylo Pty Ltd (AU) 2025-01-02 — — WO 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-20250214943-A1 Compounds NLN, SLC18A2, PYGB HTR2A 94/4885HRH3 2746/4885ABCC1 2325/4885
US-12428380-B2 Compounds NLN, SLC18A2, PYGB HTR2A 94/4885HRH3 2746/4885ABCC1 2325/4885
US-20250353818-A1 Compounds NLN, SLC18A2, PYGB HTR2A 94/4885HRH3 2746/4885ABCC1 2325/4885

“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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