SCHEMBL4900435

SCHEMBL4900435

CC(C)(C)OC(=O)N1CCC(Oc2c[c]ccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.58
KDM1A O60341 1/20 0.50
USP30 Q70CQ3 1/20 0.50
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL5268593 0.85 GPR119 (0.65) GPR119KDM1AUSP30ALDH1A1
SCHEMBL951540 0.84 GPR119 (0.67) GPR119USP30ALDH1A1
SCHEMBL4504506 0.82 EPHX2 (0.41) GPR119
SCHEMBL3605978 0.81 GPR119 (0.69) GPR119KDM1A
SCHEMBL30876497 0.81 GPR119 (0.57) GPR119KDM1AUSP30
SCHEMBL22387771 0.81 GPR119 (0.60) GPR119KDM1AUSP30
SCHEMBL1809399 0.81 GPR119 (0.57) GPR119KDM1AUSP30
SCHEMBL693678 0.81 GPR119 (0.55) GPR119
SCHEMBL29796027 0.80 KDM1A (0.58) GPR119KDM1AUSP30
SCHEMBL6481542 0.80 GPR119 (0.62) GPR119KDM1AUSP30

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-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof JAPAN TOBACCO INC. 2008-10-02 US disclosed
US-20050222146-A1 N-substituted-n-sulfonylaminocyclopropane compounds and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2005-10-06 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 (2 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-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof MMP13, MMP11, MMP3 GPR119 783/4885KDM1A 512/4885USP30 2655/4885
US-20050222146-A1 N-substituted-n-sulfonylaminocyclopropane compounds and pharmaceutical use thereof MMP13, MMP11, MMP1 GPR119 784/4885KDM1A 477/4885USP30 2747/4885

“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.