SCHEMBL25826819

SCHEMBL25826819

C[C@H](COCc1nn(C)cc1Br)NC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.37
PPARG P37231 1/20 0.36
CTSS P25774 3/20 0.35
AAK1 Q2M2I8 6/20 0.35
CA2 P00918 3/20 0.34
CA1 P00915 2/20 0.34
CA7 P43166 2/20 0.34
CA4 P22748 1/20 0.34
CA9 Q16790 1/20 0.34
CTSK P43235 3/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.32

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
SCHEMBL30450003 0.84 ATM (0.36) ALDH1A1MAPK1
SCHEMBL30450496 0.80 KMT2A (0.37) PPARAPPARGCTSSAAK1CA2
SCHEMBL25826817 0.79 ADORA2A (0.41) CA2CA1CA9ALDH1A1
SCHEMBL31465655 0.79 NPSR1 (0.34) AAK1ALDH1A1
SCHEMBL25826914 0.79 NPSR1 (0.34) AAK1ALDH1A1
SCHEMBL31304940 0.78 PPARA (0.38) PPARAPPARGCTSSCTSKALDH1A1
SCHEMBL29456690 0.75 KDM4E (0.44) CA2CA1CA9ALDH1A1MAPK1
SCHEMBL31304946 0.75 ALDH1A1 (0.37) ALDH1A1
SCHEMBL19403329 0.74 KMT2A (0.40) CTSSAAK1CA2CA1CA7
SCHEMBL19403330 0.74 KMT2A (0.40) CTSSAAK1CA2CA1CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739694-A2 MACROCYCLIC COMPOUNDS AND USE AS TYK2 INHIBITORS Blossomhill Therapeutics, Inc. (US) 2026-05-13 EP disclosed
US-20250074920-A1 MACROCYCLIC COMPOUNDS AND USE AS KINASE INHIBITORS BLOSSOMHILL THERAPEUTICS INC (US) 2025-03-06 US disclosed
WO-2025010294-A2 MACROCYCLIC COMPOUNDS AND USE AS TYK2 INHIBITORS BLOSSOMHILL THERAPEUTICS, INC. (US) 2025-01-09 WO disclosed
EP-4460498-A1 MACROCYCLIC COMPOUNDS AND USE AS KINASE INHIBITORS Blossomhill Therapeutics, Inc. (US) 2024-11-13 EP disclosed
WO-2023133375-A1 MACROCYCLIC COMPOUNDS AND USE AS KINASE INHIBITORS BLOSSOMHILL THERAPEUTICS, INC. (US) 2023-07-13 WO disclosed
WO-2023133375-A1 MACROCYCLIC COMPOUNDS AND USE AS KINASE INHIBITORS BLOSSOMHILL THERAPEUTICS, INC. (US) 2023-07-13 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-20250074920-A1 MACROCYCLIC COMPOUNDS AND USE AS KINASE INHIBITORS MAP3K20, MAP3K8, PRKACA PPARA 3451/4885PPARG 1727/4885CTSS 1353/4885

“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.