SCHEMBL6041129

SCHEMBL6041129

CCOC(=O)C1CCN(c2ccnc(Oc3ccc(C(=O)CC)cc3)c2[N+](=O)[O-])CC1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.66
MAPT P10636 5/20 0.51
TP53 P04637 1/20 0.51
HTT P42858 1/20 0.51
CTSB P07858 1/20 0.50
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.42

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
SCHEMBL1673722 0.90 GPR119 (0.58) GPR119MAPTTP53HTTCTSB
SCHEMBL390641 0.87 GPR119 (0.86) GPR119MAPTTP53HTTALDH1A1
SCHEMBL386411 0.85 GPR119 (0.77) GPR119MAPTTP53HTTCTSB
SCHEMBL6041144 0.80 GPR119 (0.92) GPR119MAPTTP53HTTALDH1A1
SCHEMBL6041176 0.80 ALDH1A1 (0.50) GPR119MAPTTP53HTTCTSB
SCHEMBL388361 0.80 GPR119 (1.00) GPR119MAPTTP53HTTALDH1A1
SCHEMBL390329 0.80 GPR119 (0.82) GPR119MAPTTP53HTTALDH1A1
SCHEMBL1673608 0.79 GPR119 (0.81) GPR119MAPTTP53HTTALDH1A1
SCHEMBL12733498 0.78 GPR119 (0.86) GPR119MAPTALDH1A1POLBKMT2A
SCHEMBL5261829 0.78 GPR119 (0.45) GPR119MAPTTP53HTTCTSB

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-8293751-B2 1,2,3-trisubstituted aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto such as diabetes and hyperglycemia ARENA PHARMACEUTICALS, INC. (US) 2012-10-23 US disclosed
US-20060217379-A1 1,2,3-Trisubstituted aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto such as diabetes and hyperglycemia ARENA PHARMACEUTICALS 2006-09-28 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-20060217379-A1 1,2,3-Trisubstituted aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto such as diabetes and hyperglycemia UGT1A1, GPR119, UGT1A3 GPR119 2/4885MAPT 4467/4885TP53 3694/4885

“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.