SCHEMBL25227116

SCHEMBL25227116

CC(C)(C)OC(=O)N1CCCC(c2ccc(N)c(Br)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 1/20 0.51
▸ NAMPT P43490 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ HPGD P15428 1/20 0.43
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43
▸ HRH3 Q9Y5N1 4/20 0.43
▸ GPR119 Q8TDV5 4/20 0.43
▸ HDAC1 Q13547 2/20 0.42
▸ HDAC2 Q92769 2/20 0.42
▸ HDAC3 O15379 1/20 0.42

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
SCHEMBL2913125 0.95 PDE4B (0.52) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL14225752 0.93 PDE4B (0.53) PDE4BMAPTHDAC1HDAC2HDAC3
SCHEMBL25202320 0.92 PDE4B (0.59) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL12479918 0.85 NAMPT (0.52) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL30778326 0.85 NAMPT (0.54) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL15157112 0.85 NAMPT (0.54) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL14225756 0.84 PDE4B (0.53) PDE4BMAPTHDAC1HDAC2HDAC3
SCHEMBL25539754 0.84 PDE4B (0.53) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL9962347 0.84 PDE4B (0.54) PDE4BKDM4EMAPTTHRBHDAC1
SCHEMBL25203147 0.83 NAMPT (0.56) PDE4BNAMPTKDM4EMAPTTHRB

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-20240308994-A1 ISOXAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY ERICA CAMPUS (KR) 2024-09-19 — — US disclosed
WO-2023096304-A1 ISOXAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF 한양대학교 에리카산학협력단 2023-06-01 — — WO disclosed
WO-2023096304-A1 ISOXAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF 한양대학교 에리카산학협력단 2023-06-01 — — 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-20240308994-A1 ISOXAZOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND USE THEREOF CSF1R, CSF3R, IL15RA PDE4B 324/4885NAMPT 2030/4885KDM4E 2828/4885

“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.

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