SCHEMBL29121922

SCHEMBL29121922

COC(=O)c1c2cc(Br)ccc2nn1C1CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 2/20 0.43
▸ FPR2 P25090 3/20 0.41
▸ SSTR4 P31391 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KRAS P01116 2/20 0.37
▸ BACE1 P56817 2/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ EPHA2 P29317 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ FPR3 P25089 1/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ RORC P51449 2/20 0.36
▸ EHMT2 Q96KQ7 1/20 0.36
▸ NR1H2 P55055 1/20 0.36

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
SCHEMBL29122384 0.92 USP30 (0.44) USP30FPR2BACE1EPHA2FPR3
SCHEMBL29122091 0.92 USP30 (0.44) USP30FPR2BACE1EPHA2FPR3
SCHEMBL29122086 0.92 USP30 (0.44) USP30FPR2BACE1EPHA2FPR3
SCHEMBL29122496 0.90 FPR2 (0.44) USP30FPR2BACE1
SCHEMBL29122009 0.83 USP30 (0.41) USP30FPR2L3MBTL1KRASEPHA2
SCHEMBL29121975 0.83 L3MBTL1 (0.39) L3MBTL1KRASBACE1TSHRHTT
SCHEMBL29122435 0.82 USP30 (0.42) USP30FPR2SSTR4KRASBACE1
SCHEMBL29121823 0.80 MAPK8 (0.45) L3MBTL1TSHRHTT
SCHEMBL29122733 0.80 L3MBTL1 (0.43) L3MBTL1TSHRHTT
SCHEMBL28387098 0.79 MAPK8 (0.47) L3MBTL1TSHRHTT

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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 — — US disclosed
US-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 — — US disclosed
CN-117120419-A KLK5 bicyclic heteroaromatic inhibitors 拜奥克里斯特制药公司 2023-11-24 — — 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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 KLK5, KLK1, KLKB1 USP30 2072/4885FPR2 4194/4885SSTR4 4502/4885

“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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