SCHEMBL29619175

SCHEMBL29619175

Cc1noc(C)c1-c1cc(NC(=O)c2ncsc2C)ccc1OC[C@H]1CCCCN1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 9/20 0.37
GRM4 Q14833 5/20 0.37
CHRNB2 P17787 2/20 0.36
CHRNA4 P43681 1/20 0.36
CREBBP Q92793 1/20 0.36
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36
CHRNA5 P30532 1/20 0.36
NAMPT P43490 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL29619164 0.90 CRACR2A (0.38) CHRNB2CHRNA4CREBBPCHRNB4CHRNA3
SCHEMBL31677794 0.90 GRM1 (0.39) GRM1GRM4CHRNB2CHRNA4CHRNB4
SCHEMBL29619081 0.88 CHRNB2 (0.36) CHRNB2CHRNA4CREBBPCHRNB4CHRNA3
SCHEMBL29619137 0.88 CREBBP (0.39) CHRNB2CHRNA4CREBBPCHRNB4CHRNA3
SCHEMBL29619112 0.88 CHRNB2 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA5
SCHEMBL29619044 0.87 KDM4E (0.40) GRM1GRM4CHRNB2CHRNA4CREBBP
SCHEMBL29619127 0.87 HTT (0.37) CHRNB2CHRNA4CREBBPCHRNB4CHRNA3
SCHEMBL31199048 0.85 LMNA (0.41) CHRNB2CHRNA4CREBBP
SCHEMBL29619050 0.84 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA5
SCHEMBL29619060 0.84 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA5

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-20240376090-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERED RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2024-11-14 US disclosed
EP-4236942-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2023-09-06 EP disclosed
WO-2022093850-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2022-05-05 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-20240376090-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERED RELATED THERETO HTR2A, HTR5A, HTR1A GRM1 133/4885GRM4 142/4885CHRNB2 144/4885

“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.