SCHEMBL24700142

SCHEMBL24700142

CC(C)(C)OC(=O)N1CCC(c2ccccc2)CC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.45
GPR119 Q8TDV5 1/20 0.44
RORC P51449 3/20 0.42
SLC18A3 Q16572 1/20 0.42
ABCB1 P08183 1/20 0.42
HPGDS O60760 2/20 0.41
TP53 P04637 3/20 0.41
HSD11B1 P28845 1/20 0.41
LMNA P02545 1/20 0.41
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
KDM1A O60341 1/20 0.40
HCRTR2 O43614 1/20 0.40
TRPA1 O75762 1/20 0.40
MAPT P10636 1/20 0.39

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
Formamide SCHEMBL8801927 0.94 NAMPT (0.41) NAMPTGPR119RORCSLC18A3ABCB1
SCHEMBL24700396 0.88 NAMPT (0.45) NAMPTGPR119SLC18A3KDM4EPKM
SCHEMBL27167735 0.88 NAMPT (0.41) NAMPTGPR119SLC18A3HSD11B1KDM4E
SCHEMBL27168043 0.88 NAMPT (0.41) NAMPTGPR119SLC18A3HSD11B1KDM4E
SCHEMBL16004560 0.87 RORC (0.46) NAMPTGPR119RORCABCB1HSD11B1
SCHEMBL24700413 0.82 AGTR2 (0.43) TP53LMNAHCRTR2
SCHEMBL23124093 0.82 TRPA1 (0.46) SLC18A3TP53HSD11B1TRPA1
SCHEMBL24700139 0.82 GPR119 (0.47) GPR119HPGDSHSD11B1
SCHEMBL29709707 0.81 PDE4B (0.39) NAMPTHSD11B1KDM4EKDM1AMAPT
SCHEMBL24793969 0.81 PDE4B (0.39) NAMPTHSD11B1KDM4EKDM1AMAPT

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 NAMPT 92/4885GPR119 501/4885RORC 1536/4885

“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.