SCHEMBL2016797

SCHEMBL2016797

Clc1cnc(N2CCC(n3ncc4c(Oc5ccc(-n6cnnn6)cc5)ncnc43)CC2)nc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.48
CYP3A4 P08684 2/20 0.43
KCNH2 Q12809 2/20 0.38
F2 P00734 1/20 0.34
NOTUM Q6P988 1/20 0.34
KMT2A Q03164 4/20 0.34
POLB P06746 3/20 0.34
MEN1 O00255 3/20 0.33
CTDSP1 Q9GZU7 2/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33

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
SCHEMBL12574298 0.92 GPR119 (0.49) GPR119CYP3A4KMT2APOLBMEN1
SCHEMBL2017626 0.89 CYP3A4 (0.49) GPR119CYP3A4KCNH2KMT2APOLB
SCHEMBL2021367 0.89 GPR119 (0.61) GPR119CYP3A4KMT2APOLBMEN1
SCHEMBL2019585 0.87 GPR119 (0.43) GPR119CYP3A4KCNH2
SCHEMBL4352311 0.83 CYP3A4 (0.53) GPR119CYP3A4KMT2APOLBMEN1
SCHEMBL12574295 0.80 GPR119 (0.44) GPR119CYP3A4KCNH2
SCHEMBL1129044 0.79 CYP3A4 (0.70) GPR119CYP3A4
SCHEMBL2017035 0.79 CYP3A4 (0.55) GPR119CYP3A4KCNH2ALDH1A1
SCHEMBL2021985 0.79 GPR119 (0.52) GPR119CYP3A4
SCHEMBL2022039 0.78 GPR119 (0.42) GPR119CYP3A4KCNH2NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110160222-A1 MODULATORS OF GLUCOSE HOMEOSTASIS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX, INC. 2011-06-30 US claimed
US-20110160222-A1 MODULATORS OF GLUCOSE HOMEOSTASIS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX, INC. 2011-06-30 US disclosed
US-20110160222-A1 MODULATORS OF GLUCOSE HOMEOSTASIS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX, INC. 2011-06-30 US disclosed
US-20110160222-A1 MODULATORS OF GLUCOSE HOMEOSTASIS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX, INC. 2011-06-30 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-20110160222-A1 MODULATORS OF GLUCOSE HOMEOSTASIS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS GPR119, GCKR, GID4 GPR119 1/4885CYP3A4 789/4885KCNH2 3153/4885

“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.