SCHEMBL27223580

SCHEMBL27223580

O=C(O)N1CC=CCC[C@@H]1c1cc(Cl)ccc1Br

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FDFT1 P37268 1/20 0.33
▸ PTGDR2 Q9Y5Y4 6/20 0.32
▸ PTGDR Q13258 4/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ MGLL Q99685 2/20 0.32
▸ PTGER2 P43116 1/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ KDM4C Q9H3R0 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ NOTUM Q6P988 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ AGTR1 P30556 1/20 0.31
▸ CDC25B P30305 1/20 0.30

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
SCHEMBL27231932 1.00 FDFT1 (0.33) FDFT1PTGDR2PTGDRTSHRMAPK1
SCHEMBL26665067 0.87 ATM (0.36) FDFT1TSHRMAPK1HTTMAPT
SCHEMBL26665063 0.87 ATM (0.36) FDFT1TSHRMAPK1HTTMAPT
SCHEMBL26665065 0.87 ATM (0.36) FDFT1TSHRMAPK1HTTMAPT
SCHEMBL30749247 0.83 ALDH1A1 (0.40) TSHRHTTLMNAMAPTCYP2C9
SCHEMBL27224163 0.82 TDP1 (0.36) PTGDR2PTGDRTSHRMAPK1HTT
SCHEMBL27224212 0.82 TDP1 (0.36) PTGDR2PTGDRTSHRMAPK1HTT
SCHEMBL30749282 0.82 ALDH1A1 (0.35) TSHRHTTLMNAMAPT
SCHEMBL31556626 0.71 TSHR (0.32) TSHRMAPK1HTTLMNA
SCHEMBL27231815 0.71 TSHR (0.32) TSHRMAPK1HTTLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240166642-A1 INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-05-23 — — US disclosed
WO-2024038131-A1 INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-02-22 — — 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-20240166642-A1 INHIBITORS OF MYELOPEROXIDASE MPO, XDH, EPX FDFT1 3142/4885PTGDR2 1823/4885PTGDR 1567/4885

“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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