SCHEMBL24700458

SCHEMBL24700458

CC(C)(C)OC(=O)N1CC(Cc2ccccc2)C(N2CCCCC2)CC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ STS P08842 1/20 0.39
▸ NR1H2 P55055 2/20 0.38
▸ NR1H3 Q13133 2/20 0.38
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ KLK7 P49862 2/20 0.37
▸ KLK5 Q9Y337 1/20 0.37
▸ OPRK1 P41145 1/20 0.36
▸ SIGMAR1 Q99720 3/20 0.36
▸ USP30 Q70CQ3 1/20 0.35
▸ GPR119 Q8TDV5 2/20 0.35
▸ PLA2G10 O15496 1/20 0.35
▸ PLA2G5 P39877 1/20 0.35
▸ CTSL P07711 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
SCHEMBL23123605 0.89 KEAP1 (0.39) SIGMAR1
SCHEMBL24700457 0.82 RORC (0.42) NR1H2NR1H3SIGMAR1GPR119
SCHEMBL23124014 0.80 HRH3 (0.43) SIGMAR1
SCHEMBL24700422 0.78 HPGD (0.39) NR1H2OPRK1
SCHEMBL23123407 0.77 NAMPT (0.43) —
SCHEMBL23123350 0.77 MEN1 (0.40) —
SCHEMBL24700156 0.72 KLK7 (0.43) STSNR1H2NR1H3JAK2JAK1
SCHEMBL16004560 0.70 RORC (0.46) USP30GPR119
SCHEMBL31756516 0.69 USP30 (0.44) STSJAK2JAK1USP30GPR119
SCHEMBL31756581 0.69 USP30 (0.44) STSJAK2JAK1USP30GPR119

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-20220380314-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-01 — — US disclosed
CN-114901652-A Substituted saturated and unsaturated N-heterocyclic carboxamides and related compounds for the treatment of medical disorders 比亚尔R&D投资股份公司 2022-08-12 — — 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-20220380314-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GBA2, CLN6 STS 601/4885NR1H2 445/4885NR1H3 449/4885

“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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