SCHEMBL23093236

SCHEMBL23093236

COc1ncc(Cl)nc1-c1ccc(S(C)(=O)=O)nc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.41
▸ CCR4 P51679 10/20 0.39
▸ PIK3CD O00329 5/20 0.39
▸ PIK3CB P42338 3/20 0.39
▸ PIK3CG P48736 3/20 0.39
▸ PIP5K1C O60331 1/20 0.39
▸ PI4KA P42356 1/20 0.39
▸ PI4KB Q9UBF8 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.37
▸ PIK3CA P42336 2/20 0.36
▸ POLQ O75417 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.34
▸ ABCC4 O15439 1/20 0.34
▸ ABCB11 O95342 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ MAPK14 Q16539 1/20 0.34

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
SCHEMBL23093460 0.83 LRRK2 (0.48) CCR4LRRK2ABCC4ABCB11PTGS1
SCHEMBL29802431 0.83 LRRK2 (0.48) CCR4LRRK2ABCC4ABCB11PTGS1
SCHEMBL23110566 0.75 MAPT (0.34) CCR4
SCHEMBL23093472 0.73 LRRK2 (0.42) CCR4LRRK2PTGS1PTGS2
SCHEMBL26106996 0.73 PIK3CD (0.48) FAAHPIK3CDPIK3CBPIK3CGPIP5K1C
SCHEMBL26107943 0.72 PI4KB (0.55) FAAHPIK3CDPIK3CBPIK3CGPIP5K1C
SCHEMBL23110907 0.71 CCR4 (0.34) CCR4PTGS1PTGS2MAPK14
SCHEMBL23093139 0.69 LRRK2 (0.48) CCR4LRRK2PTGS1PTGS2
SCHEMBL23093414 0.66 KCNH2 (0.55) PI4KBPIK3CAPTGS1PTGS2
SCHEMBL12508082 0.66 NFE2L2 (0.49) PDE10APTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220348590-A1 CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF THE BOARD INSTITUTE, INC. (US) 2022-11-03 — — US disclosed
EP-4027993-A1 CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF The Broad Institute Inc. (US) 2022-07-20 — — EP disclosed
WO-2021050700-A1 CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2021-03-18 — — WO disclosed
WO-2021050700-A1 CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2021-03-18 — — 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-20220348590-A1 CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF PTGES2, PTGS2, PTGES FAAH 283/4885CCR4 2766/4885PIK3CD 1533/4885

“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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