SCHEMBL29619084

SCHEMBL29619084

Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OCCN1CC[C@@H](O)C1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 9/20 0.48
HTR2C P28335 8/20 0.48
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PDE5A O76074 1/20 0.41
BRD4 O60885 1/20 0.41
BRD2 P25440 1/20 0.41
BRD3 Q15059 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ABL1 P00519 2/20 0.39

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
SCHEMBL29619116 1.00 HTR2A (0.48) HTR2AHTR2CMAPTLMNASMN1; SMN2
SCHEMBL29619056 0.95 HTR2A (0.53) HTR2AHTR2CMAPTLMNASMN1; SMN2
SCHEMBL29619080 0.90 HTR2A (0.49) HTR2AHTR2CMAPTLMNASMN1; SMN2
SCHEMBL29619079 0.90 HTR2A (0.49) HTR2AHTR2CMAPTLMNASMN1; SMN2
SCHEMBL29619101 0.90 HTR2A (0.49) HTR2AHTR2CBRD4BRD2BRD3
SCHEMBL29619051 0.90 HTR2A (0.51) HTR2AHTR2C
SCHEMBL29619130 0.88 HTR2A (0.55) HTR2AHTR2CMAPTLMNASMN1; SMN2
SCHEMBL29619000 0.88 MAPT (0.45) HTR2AHTR2CMAPTLMNASMN1; SMN2
SCHEMBL29619153 0.88 HTR2A (0.51) HTR2AHTR2CBRD4BRD2BRD3
SCHEMBL29619059 0.86 HTR2A (0.52) HTR2AHTR2CMAPTLMNASMN1; SMN2

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 HTR2A 1/4885HTR2C 4/4885MAPT 1759/4885

“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.