SCHEMBL24700396

SCHEMBL24700396

CC(C)(C)OC(=O)N1CCC(N2CCC(c3ccccc3)CC2)CC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.45
GRIN2B Q13224 3/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
SLC18A3 Q16572 6/20 0.42
HCRTR2 O43614 1/20 0.41
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
OPRL1 P41146 1/20 0.40
TACR1 P25103 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
PKM P14618 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
SCHEMBL24700142 0.88 NAMPT (0.45) NAMPTKDM4ESLC18A3HCRTR2GPR119
SCHEMBL24700413 0.87 AGTR2 (0.43) ALDH1A1HCRTR2
Formamide SCHEMBL8801927 0.83 NAMPT (0.41) NAMPTKDM4ESLC18A3HCRTR2GPR119
SCHEMBL29795102 0.81 SLC18A3 (0.42) KDM4EALDH1A1SLC18A3OPRL1
SCHEMBL24700468 0.81 RIPK1 (0.41) KDM4EGPR119PKM
SCHEMBL24700163 0.80 HPGD (0.43) ALDH1A1
SCHEMBL4077656 0.79 NAMPT (0.54) NAMPTGRIN2BKDM4EALDH1A1TACR1
SCHEMBL16004560 0.78 RORC (0.46) NAMPTTACR1GPR119
SCHEMBL24700587 0.78 CHRM2 (0.36)
SCHEMBL30761098 0.77 USP2 (0.47) GPR119

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 1 patent. 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

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 92/4885GRIN2B 1116/4885KDM4E 2486/4885

“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.