SCHEMBL9993018

SCHEMBL9993018

CC(C)(C)OC(=O)N1CCC2(CC1)CC(CNC(=O)OCc1cc(C(N)=O)no1)C2

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 11/20 0.53
GPR119 Q8TDV5 5/20 0.41
PKM P14618 1/20 0.40
SCD5 Q86SK9 1/20 0.40

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
SCHEMBL9994209 0.89 NAMPT (0.44) NAMPTGPR119PKMSCD5
SCHEMBL9994834 0.87 NAMPT (0.38) NAMPT
SCHEMBL9994673 0.85 NAMPT (0.47) NAMPTGPR119PKMSCD5
SCHEMBL9993019 0.83 SCD5 (0.45) NAMPTGPR119PKMSCD5
SCHEMBL9994514 0.79 NAMPT (0.44) NAMPTGPR119PKMSCD5
SCHEMBL29179904 0.79 NAMPT (0.55) NAMPTGPR119PKM
SCHEMBL346185 0.76 PKM (0.42) NAMPTPKMSCD5
SCHEMBL9993013 0.75 NAMPT (0.46) NAMPTGPR119PKMSCD5
SCHEMBL9993034 0.75 NAMPT (0.36) NAMPT
SCHEMBL345715 0.75 KDM4E (0.46) NAMPTPKM

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-8889702-B2 Derivatives of azaspiranyl-alkylcarbamates of 5-member heterocyclic compounds, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-11-18 US disclosed
US-20110319381-A1 DERIVATIVES OF AZASPIRANYL-ALKYLCARBAMATES OF 5-MEMBER HETEROCYCLIC COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-12-29 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-20110319381-A1 DERIVATIVES OF AZASPIRANYL-ALKYLCARBAMATES OF 5-MEMBER HETEROCYCLIC COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF PRMT9, IDH3B, DHFR NAMPT 54/4885GPR119 1390/4885PKM 4286/4885

“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.