SCHEMBL25028270

SCHEMBL25028270

CNCCc1c[nH]c2c(C)c(F)cc(OC(C)=O)c12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 1/20 0.38
▸ HTR2A P28223 1/20 0.37
▸ MTNR1A P48039 11/20 0.37
▸ MTNR1B P49286 10/20 0.37
▸ MPO P05164 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ HTR2C P28335 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NQO2 P16083 1/20 0.34
▸ NOTUM Q6P988 1/20 0.33
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33

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
SCHEMBL25029617 0.89 MPO (0.39) HTR2BHTR2AMTNR1AMTNR1BMPO
SCHEMBL25029941 0.84 HTR1A (0.48) HTR2BHTR2AHTR2C
SCHEMBL25030358 0.82 HTR1D (0.41) HTR2BHTR2AHTR2CCYP4F2CYP4A11
SCHEMBL25030327 0.80 HTR2A (0.42) HTR2AMTNR1AMTNR1BKDM4EALDH1A1
SCHEMBL25030193 0.79 HTR2A (0.49) HTR2AMPOKDM4EALDH1A1LMNA
SCHEMBL25029964 0.79 MPO (0.46) HTR2BHTR2AMTNR1AMTNR1BMPO
SCHEMBL25987632 0.78 HTR2A (0.38) HTR2AMTNR1AMTNR1BKDM4EALDH1A1
SCHEMBL25029796 0.78 MTNR1A (0.40) HTR2BHTR2AMTNR1AMTNR1BMPO
SCHEMBL23069143 0.72 MTNR1A (0.64) HTR2BHTR2AMTNR1AMTNR1BMPO
SCHEMBL29967548 0.72 MTNR1A (0.64) HTR2BHTR2AMTNR1AMTNR1BMPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118055766-A Magic and non-magic serotonin receptor agonist and its preparing process and usage 库莱恩有限责任公司 2024-05-17 — — CN 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 (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-20230257346-A1 BENZOSELENOPHENE AND SELENOPHENOPYRIDINE ANALOGS AND METHODS OF MODULATING THE SEROTONIN 5-HT2C RECEPTOR HTR2C, HTR2A, HTR3B HTR2B 4/4885HTR2A 2/4885MTNR1A 293/4885

“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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