SCHEMBL25029800

SCHEMBL25029800

CCNCCc1c[nH]c2nc(F)cc(O)c12

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 6/20 0.45
▸ HTR2A P28223 6/20 0.43
▸ HTR1A P08908 3/20 0.39
▸ HTR6 P50406 2/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A2 P23975 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ DRD2 P14416 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ IDO1 P14902 1/20 0.31
▸ KCNT1 Q5JUK3 1/20 0.31

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
SCHEMBL25987650 0.86 HTR2A (0.50) MPOHTR2AHTR1AHTR6MEN1
SCHEMBL31708192 0.80 HTR1A (0.63) MPOHTR2AHTR1AHTR6SLC6A4
SCHEMBL25029791 0.79 MTNR1A (0.40) MPOHTR2ASLC6A4MEN1KMT2A
SCHEMBL25029889 0.75 HTR2A (0.48) MPOHTR2AHTR1AHTR6SLC6A2
SCHEMBL25029539 0.75 MPO (0.33) MPOHTR2A
SCHEMBL25029861 0.75 MPO (0.44) MPOHTR2AHTR1AHTR6SLC6A4
SCHEMBL25029536 0.75 MPO (0.33) MPOHTR2A
SCHEMBL25030273 0.73 MPO (0.55) MPOHTR2AHTR1AHTR6SLC6A4
SCHEMBL31708041 0.69 MPO (0.57) MPOHTR2ASLC6A4SLC6A2MEN1
SCHEMBL25030287 0.68 HTR2A (0.76) MPOHTR2AHTR1AHTR6SLC6A2

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-11780807-B2 Benzoselenophene, benzothiophene, and benzofuran analogs and methods of modulating the serotonin 5-HT2C receptor Kuleon, LLC (US) 2023-10-10 — — US disclosed
US-11780807-B2 Benzoselenophene, benzothiophene, and benzofuran analogs and methods of modulating the serotonin 5-HT2C receptor Kuleon, LLC (US) 2023-10-10 — — US disclosed
US-20230257346-A1 BENZOSELENOPHENE AND SELENOPHENOPYRIDINE ANALOGS AND METHODS OF MODULATING THE SEROTONIN 5-HT2C RECEPTOR Kuleon, LLC (US) 2023-08-17 — — US disclosed
US-20230257346-A1 BENZOSELENOPHENE AND SELENOPHENOPYRIDINE ANALOGS AND METHODS OF MODULATING THE SEROTONIN 5-HT2C RECEPTOR Kuleon, LLC (US) 2023-08-17 — — US disclosed
WO-2023018864-A1 HALLUCINOGENIC AND NON-HALLUCINOGENIC SEROTONIN RECEPTOR AGONISTS AND METHODS OF MAKING AND USING THE SAME PSILOSTERICS, LLC (US) 2023-02-16 — — 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 (2 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-11780807-B2 Benzoselenophene, benzothiophene, and benzofuran analogs and methods of modulating the serotonin 5-HT2C receptor HTR2C, HTR2A, HTR3C MPO 4717/4885HTR2A 2/4885HTR1A 8/4885
US-20230257346-A1 BENZOSELENOPHENE AND SELENOPHENOPYRIDINE ANALOGS AND METHODS OF MODULATING THE SEROTONIN 5-HT2C RECEPTOR HTR2C, HTR2A, HTR3B MPO 3274/4885HTR2A 2/4885HTR1A 9/4885

“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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