SCHEMBL29619181

SCHEMBL29619181

Cc1noc(C)c1-c1cc(NC(=O)C2CC2)ccc1OC[C@H]1COCCN1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CNR2 P34972 1/20 0.37
GABRA5 P31644 1/20 0.37
IRAK4 Q9NWZ3 2/20 0.37
CREBBP Q92793 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HTR2A P28223 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
SCHEMBL29619134 1.00 ABL1 (0.40) ABL1MAPTLMNASMN1; SMN2CNR2
SCHEMBL29619058 0.89 MAPT (0.42) MAPTLMNASMN1; SMN2GABRA5MEN1
SCHEMBL24398568 0.89 CHRNB2 (0.43) MAPTLMNASMN1; SMN2GABRA5POLB
SCHEMBL29619133 0.89 CHRNB2 (0.43) MAPTLMNASMN1; SMN2GABRA5POLB
SCHEMBL29619060 0.88 CHRNB2 (0.40) MAPTLMNASMN1; SMN2GABRA5POLB
SCHEMBL29619050 0.88 CHRNB2 (0.40) MAPTLMNASMN1; SMN2GABRA5POLB
SCHEMBL29619091 0.80 GABRA5 (0.46) ABL1MAPTLMNASMN1; SMN2GABRA5
SCHEMBL29619109 0.79 MAPT (0.44) MAPTLMNASMN1; SMN2GABRA5CREBBP
SCHEMBL29619204 0.79 BRD4 (0.38) MEN1KMT2A
SCHEMBL24398567 0.79 POLB (0.52) MAPTLMNASMN1; SMN2MEN1KMT2A

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 ABL1 2898/4885MAPT 1759/4885LMNA 2981/4885

“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.