SCHEMBL29619035

SCHEMBL29619035

CNc1ccc(OC[C@H]2CCCCN2C(=O)OC(C)(C)C)c(-c2c(C)noc2C)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 4/20 0.40
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
GPR119 Q8TDV5 3/20 0.38
EPHA2 P29317 1/20 0.38
KDR P35968 1/20 0.38
EPHB4 P54760 1/20 0.38
FPR3 P25089 1/20 0.36
FPR2 P25090 1/20 0.36
KDM1A O60341 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CHEK2 O96017 1/20 0.35
NPC1 O15118 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 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
SCHEMBL29619014 0.91 NPC1 (0.42) F2RL3ALOX5APFEN1FPR3FPR2
SCHEMBL29619065 0.90 F2RL3 (0.38) F2RL3ALOX5APFEN1GPR119EPHA2
SCHEMBL29619024 0.88 ALOX5AP (0.43) F2RL3ALOX5APFEN1GPR119EPHA2
SCHEMBL29619089 0.86 MCHR1 (0.37) F2RL3ALOX5APFEN1GPR119EPHA2
SCHEMBL29619027 0.85 NPC1 (0.42) GPR119NPC1
SCHEMBL29619033 0.83 F2RL3 (0.38) F2RL3ALOX5APFEN1GPR119ALDH1A1
SCHEMBL31663763 0.80 NPC1 (0.44) F2RL3ALOX5APFEN1FPR3FPR2
SCHEMBL31663765 0.80 NPC1 (0.44) F2RL3ALOX5APFEN1FPR3FPR2
SCHEMBL31663788 0.80 NPC1 (0.44) F2RL3ALOX5APFEN1FPR3FPR2
SCHEMBL31663811 0.79 FPR3 (0.39) F2RL3ALOX5APFEN1EPHA2KDR

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 F2RL3 1301/4885ALOX5AP 177/4885FEN1 4482/4885

“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.