SCHEMBL29122435

SCHEMBL29122435

CC(C)(C)OC(=O)N1CC(n2nc3ccc(Br)cc3c2CO)C1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 2/20 0.42
▸ FPR2 P25090 3/20 0.39
▸ KCNK3 O14649 1/20 0.39
▸ KCNK9 Q9NPC2 1/20 0.39
▸ KRAS P01116 4/20 0.38
▸ SSTR4 P31391 1/20 0.38
▸ RORC P51449 2/20 0.37
▸ NR1H2 P55055 1/20 0.37
▸ BACE1 P56817 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ TDO2 P48775 1/20 0.35
▸ EPHA2 P29317 2/20 0.35
▸ FPR3 P25089 1/20 0.35
▸ NAMPT P43490 1/20 0.35

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
SCHEMBL29121906 0.92 USP30 (0.42) USP30FPR2IDO1TDO2
SCHEMBL29121909 0.92 USP30 (0.42) USP30FPR2IDO1TDO2
SCHEMBL29122015 0.90 GPR119 (0.43) USP30FPR2BACE1
SCHEMBL29121838 0.84 USP30 (0.41) USP30FPR2KCNK3KCNK9KRAS
SCHEMBL29121922 0.82 USP30 (0.43) USP30FPR2KRASSSTR4RORC
SCHEMBL29121879 0.82 KMT2A (0.41) KRAS
SCHEMBL29122614 0.78 POLB (0.35) FPR2
SCHEMBL29122612 0.78 POLB (0.35) FPR2
SCHEMBL29121967 0.75 MAPT (0.36) —
SCHEMBL29122457 0.75 MAPT (0.38) —

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 4194/4885KCNK3 67/4885

“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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