SCHEMBL24027124

SCHEMBL24027124

COC(=O)C1CCN(Cc2ccccc2)CC1F

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.50
BCHE P06276 2/20 0.49
SCN4A P35499 2/20 0.48
MAOB P27338 1/20 0.48
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
SIGMAR1 Q99720 3/20 0.47

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
SCHEMBL15566220 0.86 SLC18A3 (0.52) MCHR1BCHESCN4ADRD2DRD4
SCHEMBL1282973 0.86 S1PR5 (0.53) MCHR1SCN4ADRD2DRD4SIGMAR1
SCHEMBL7818044 0.84 SLC6A2 (0.56) MCHR1
SCHEMBL10968787 0.83 SLC18A3 (0.54) MCHR1SCN4ADRD2DRD4SIGMAR1
SCHEMBL10968786 0.83 SLC18A3 (0.54) MCHR1SCN4ADRD2DRD4SIGMAR1
SCHEMBL10968782 0.83 SLC18A3 (0.54) MCHR1SCN4ADRD2DRD4SIGMAR1
SCHEMBL21806055 0.83 GAA (0.49) BCHESCN4ADRD2DRD4SIGMAR1
SCHEMBL1337120 0.82 SIGMAR1 (0.50) MCHR1SCN4ADRD2DRD4SIGMAR1
SCHEMBL28332659 0.82 SIGMAR1 (0.50) MCHR1SCN4ADRD2DRD4SIGMAR1
SCHEMBL24027193 0.81 MCHR1 (0.50) MCHR1SCN4ADRD2DRD4SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210355115-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2021-11-18 US disclosed
US-20210355115-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2021-11-18 US disclosed
CN-113056455-A Isoxazole carboxamide compounds and uses thereof 诺华股份有限公司 2021-06-29 CN 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-20210355115-A1 ISOXAZOLE CARBOXAMIDE COMPOUNDS AND USES THEREOF SLC26A4, ALDH5A1, SLC8B1 MCHR1 1817/4885BCHE 3178/4885SCN4A 720/4885

“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.