SCHEMBL25759340

SCHEMBL25759340

C=CCC1C(=O)CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 0.55
F2 P00734 3/20 0.54
CTSG P08311 2/20 0.54
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
PREP P48147 3/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL5353802 0.85 PSEN1 (0.59) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3711815 0.82 PREP (0.48) ELANEF2PSEN1PSEN2APH1B
SCHEMBL8156466 0.81 PREP (0.47) ELANEPSEN1PSEN2APH1BNCSTN
SCHEMBL3029470 0.79 HTR2C (0.53) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29606975 0.79 ELANE (0.52) ELANEF2CTSGPSEN1PSEN2
SCHEMBL30440090 0.78 FKBP1A (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL23478113 0.78 PSEN1 (0.62) ELANEPSEN1PSEN2APH1BNCSTN
SCHEMBL8132766 0.77 ELANE (0.36) ELANECTSGPSEN1PSEN2APH1B
SCHEMBL31460272 0.77 ELANE (0.54) ELANEF2CTSGPREPNPC1
SCHEMBL1660359 0.77 ELANE (0.55) ELANEF2CTSGPSEN1PSEN2

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-20230192614-A1 METHOD FOR PREPARATION OF TRANS-N-BENZYLOXYCARBONYL-(3-HYDROXY-2-PIPERIDINYL)-2-PROPANONE AS INTERMEDIATE OF HALOFUGINONE CHENGDA PHARMACEUTICALS CO., LTD. (CN) 2023-06-22 US disclosed
CN-109956966-B Method for synthesizing key chiral intermediate of dichroine 复旦大学 2021-05-04 CN disclosed
CN-109956966-A A method of synthesis orixine key chiral intermediate 复旦大学 2019-07-02 CN 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-20230192614-A1 METHOD FOR PREPARATION OF TRANS-N-BENZYLOXYCARBONYL-(3-HYDROXY-2-PIPERIDINYL)-2-PROPANONE AS INTERMEDIATE OF HALOFUGINONE TALDO1, RPL22, RPS20 ELANE 994/4885F2 1083/4885CTSG 2227/4885

“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.