SCHEMBL2897281

SCHEMBL2897281

CC(C)c1noc(N2CCC(C(C)CCOc3ccc(CC(NC(=O)OC(C)(C)C)C(=O)N4CCSC4)cc3)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 10/20 0.45
HRH1 P35367 10/20 0.45
KMT2A Q03164 2/20 0.40
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
GPR119 Q8TDV5 3/20 0.36
KCNH2 Q12809 1/20 0.36
PABPC1 P11940 1/20 0.35

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
SCHEMBL2897279 1.00 HRH2 (0.45) HRH2HRH1KMT2AMAPK1ALDH1A1
SCHEMBL2896729 0.91 HRH2 (0.47) HRH2HRH1KMT2AMAPK1ALDH1A1
SCHEMBL2891232 0.90 GPR119 (0.46) HRH2HRH1GPR119KCNH2
SCHEMBL2894479 0.90 GPR119 (0.46) HRH2HRH1GPR119KCNH2
SCHEMBL2894483 0.90 GPR119 (0.46) HRH2HRH1GPR119KCNH2
SCHEMBL2891228 0.90 GPR119 (0.46) HRH2HRH1GPR119KCNH2
SCHEMBL2894161 0.88 ITGB3 (0.49) HRH2HRH1KMT2AMAPK1ITGB3
SCHEMBL2892006 0.88 ITGB3 (0.49) HRH2HRH1KMT2AMAPK1ITGB3
SCHEMBL2894162 0.88 ITGB3 (0.49) HRH2HRH1KMT2AMAPK1ITGB3
SCHEMBL2897695 0.88 HRH2 (0.42) HRH2HRH1KMT2AMAPK1ALDH1A1

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 1577/4885KMT2A 2366/4885

“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.