SCHEMBL26508377

SCHEMBL26508377

Brc1[nH]c2ccccc2c1CCN1CCC1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 8/20 0.68
▸ HTR2C P28335 6/20 0.63
▸ DRD2 P14416 5/20 0.62
▸ BCHE P06276 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.46
▸ CHRNA7 P36544 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ MPO P05164 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ SIGMAR1 Q99720 2/20 0.40

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
SCHEMBL26675957 0.82 MAOA (0.51) HTR2AHTR2CDRD2BCHECHRNA7
SCHEMBL26508424 0.82 HTR2A (0.68) HTR2AHTR2CDRD2BCHECHRNA7
SCHEMBL26508371 0.82 HTR2A (0.72) HTR2AHTR2CDRD2BCHEHRH3
SCHEMBL25772732 0.82 HTR2A (0.68) HTR2AHTR2CDRD2BCHEHRH3
SCHEMBL26508362 0.82 HTR2A (0.68) HTR2AHTR2CDRD2BCHEHRH3
SCHEMBL26508413 0.79 HTR2A (0.64) HTR2AHTR2CDRD2BCHEHRH3
SCHEMBL26508411 0.78 HTR2A (0.63) HTR2AHTR2CDRD2BCHEHRH3
SCHEMBL9026523 0.78 HTR2A (0.66) HTR2AHTR2CDRD2BCHEHRH3
SCHEMBL7648046 0.78 HTR2A (1.00) HTR2AHTR2CDRD2KCNH2
SCHEMBL8524422 0.77 HTR2A (1.00) HTR2AHTR2CDRD2CHRNA7KCNH2

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-20230322735-A1 AZETIDINYL TRYPTAMINES AND METHODS OF TREATING PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2023-10-12 — — 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-20230322735-A1 AZETIDINYL TRYPTAMINES AND METHODS OF TREATING PSYCHIATRIC DISORDERS TPH2, TPH1, HTR2A HTR2A 3/4885HTR2C 4/4885DRD2 26/4885

“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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