SCHEMBL24700150

SCHEMBL24700150

CC1C(c2ccccc2)=CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 6/20 0.43
▸ NR1H2 P55055 5/20 0.43
▸ NR1H3 Q13133 4/20 0.43
▸ RXRA P19793 2/20 0.43
▸ GPR119 Q8TDV5 1/20 0.42
▸ UCHL1 P09936 1/20 0.40
▸ CKS1B P61024 1/20 0.40
▸ SKP1 P63208 1/20 0.40
▸ SKP2 Q13309 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ HPGDS O60760 1/20 0.38

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
SCHEMBL22142862 0.79 GPR119 (0.39) NR1H2GPR119KDM4E
SCHEMBL22142936 0.79 GPR119 (0.39) NR1H2GPR119KDM4E
SCHEMBL22142845 0.79 GPR119 (0.39) NR1H2GPR119KDM4E
SCHEMBL22142007 0.76 MAPK1 (0.37) NR1H2GPR119KDM4E
SCHEMBL22142000 0.76 MAPK1 (0.37) NR1H2GPR119KDM4E
SCHEMBL22142011 0.76 MAPK1 (0.37) NR1H2GPR119KDM4E
SCHEMBL29950673 0.73 GPR119 (0.47) USP30GPR119UCHL1KDM4E
SCHEMBL27533386 0.73 GPR119 (0.36) NR1H2GPR119KDM4E
SCHEMBL17877334 0.72 BRD4 (0.43) USP30NR1H2NR1H3RXRAGPR119
SCHEMBL24700152 0.72 GRM5 (0.42) USP30NR1H2NR1H3RXRAGPR119

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-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
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
EP-4031540-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS Bial-R&D Investments, S.A. (PT) 2022-07-27 — — EP 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 USP30 2436/4885NR1H2 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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