SCHEMBL2897012

SCHEMBL2897012

CCc1noc(N2CCC(C(C)CCOc3ccc([C@H](NC(=O)OC(C)(C)C)C(=O)N4CCCC4C(N)=O)cc3)CC2)n1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 9/20 0.36
HRH1 P35367 9/20 0.36
SPHK2 Q9NRA0 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
ENPP2 Q13822 1/20 0.34
F2RL3 Q96RI0 2/20 0.34
CMA1 P23946 2/20 0.34
ACACB O00763 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ELANE P08246 1/20 0.33
KCNH2 Q12809 1/20 0.33
F2 P00734 1/20 0.32
PRSS1 P07477 1/20 0.32

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
SCHEMBL2897008 1.00 HRH2 (0.36) HRH2HRH1SPHK2SPHK1ENPP2
SCHEMBL2897630 0.92 HRH2 (0.36) HRH2HRH1SPHK2SPHK1ENPP2
SCHEMBL2897633 0.92 HRH2 (0.36) HRH2HRH1SPHK2SPHK1ENPP2
SCHEMBL8070582 0.92 HRH2 (0.37) HRH2HRH1F2RL3ACACB
SCHEMBL2911195 0.89 HRH2 (0.38) HRH2HRH1F2RL3ACACB
SCHEMBL2911198 0.89 HRH2 (0.38) HRH2HRH1F2RL3ACACB
SCHEMBL2895468 0.87 HRH2 (0.40) HRH2HRH1ACACB
SCHEMBL2895463 0.87 HRH2 (0.40) HRH2HRH1ACACB
SCHEMBL2900161 0.87 HRH2 (0.40) HRH2HRH1ACACB
SCHEMBL2900163 0.87 HRH2 (0.40) HRH2HRH1ACACB

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-20100286112-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-11-11 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-20100286112-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS GPR119, DPP4, DPP9 HRH2 877/4885HRH1 1577/4885SPHK2 1051/4885

“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.