SCHEMBL2923786

SCHEMBL2923786

CS(=O)(=O)c1ccc(O[C@H]2CC[C@H](C(=O)N3CCN(C4CCC4)CC3)CC2)nc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.56
HRH3 Q9Y5N1 11/20 0.47
HRH1 P35367 1/20 0.47
POLB P06746 1/20 0.45
NAMPT P43490 3/20 0.43
DGAT1 O75907 1/20 0.43
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL2923782 1.00 GPR119 (0.56) GPR119HRH3HRH1POLBNAMPT
SCHEMBL2927109 0.85 GPR119 (0.57) GPR119HRH3NAMPTDGAT1
SCHEMBL2927105 0.85 GPR119 (0.57) GPR119HRH3NAMPTDGAT1
SCHEMBL2923332 0.83 HRH3 (0.52) HRH3NAMPTKCNH2
SCHEMBL2926931 0.83 HRH3 (0.52) HRH3NAMPTKCNH2
SCHEMBL2923334 0.83 HRH3 (0.52) HRH3NAMPTKCNH2
SCHEMBL2927713 0.81 HRH3 (0.55) HRH3NAMPTDGAT1KCNH2
SCHEMBL2929615 0.81 HRH3 (0.47) HRH3NAMPTKCNH2
SCHEMBL2929616 0.81 HRH3 (0.47) HRH3NAMPTKCNH2
SCHEMBL2927714 0.81 HRH3 (0.55) HRH3NAMPTDGAT1KCNH2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158189-B1 CYCLOHEXYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-09-15 EP claimed
US-7544683-B2 Cyclohexyl derivatives HOFFMANN-LA ROCHE INC. (US) 2009-06-09 US claimed
US-20090005380-A1 CYCLOHEXYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-01 US claimed
EP-2158189-B1 CYCLOHEXYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-09-15 EP disclosed
US-7544683-B2 Cyclohexyl derivatives HOFFMANN-LA ROCHE INC. (US) 2009-06-09 US disclosed
US-20090005380-A1 CYCLOHEXYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-01-01 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-20090005380-A1 CYCLOHEXYL DERIVATIVES HRH3, HRH4, HCAR2 GPR119 25/4885HRH3 1/4885HRH1 4/4885

“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.