SCHEMBL25435562

SCHEMBL25435562

COc1cc(C)c2[nH]cc(CCN(C(C)C)C(C)C)c2c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 8/20 0.56
MTNR1B P49286 8/20 0.56
HTR6 P50406 5/20 0.44
HTR1A P08908 3/20 0.44
HTR1D P28221 2/20 0.44
HTR1B P28222 2/20 0.44
HTR2A P28223 2/20 0.44
HTR2C P28335 2/20 0.44
HTR1E P28566 2/20 0.44
HTR7 P34969 2/20 0.44
HTR2B P41595 2/20 0.44
HTR5A P47898 2/20 0.44
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
HTR1F P30939 1/20 0.44
HTR3A P46098 1/20 0.44
HTR4 Q13639 1/20 0.44

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
SCHEMBL25424386 0.88 MTNR1A (0.55) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL30483727 0.88 MTNR1A (0.55) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL25423148 0.87 MTNR1A (0.55) MTNR1AMTNR1BHTR6HTR1AHTR1D
Hydrochloric Acid SCHEMBL31077661 0.86 MTNR1A (0.54) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL30483757 0.86 MTNR1A (0.43) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL25748622 0.86 MTNR1A (0.43) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL25029573 0.85 MTNR1A (0.60) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL30483771 0.85 MTNR1A (0.60) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL30886863 0.83 MTNR1A (0.58) MTNR1AMTNR1BHTR6HTR1AHTR1D
SCHEMBL25434724 0.83 HTR1A (0.62) MTNR1AMTNR1BHTR6HTR1AHTR1D

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
US-20250101038-A1 COMPOUNDS Psylo Pty Ltd (AU) 2025-03-27 US disclosed
EP-4452937-A1 COMPOUNDS Psylo Pty Ltd (AU) 2024-10-30 EP disclosed
CN-118715204-A Compounds of formula (I) 普赛洛私人有限公司 2024-09-27 CN disclosed
WO-2023115166-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 WO disclosed
WO-2023115166-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 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 (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-20250101038-A1 COMPOUNDS NLN, SLC18A2, PYGB MTNR1A 888/4885MTNR1B 461/4885HTR6 54/4885

“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.