SCHEMBL4399129

SCHEMBL4399129

CC(C)(C)OC(=O)N1CCn2cc(C(O)Cc3ccncc3)nc2C1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.45
PRKCI P41743 3/20 0.41
P2RX7 Q99572 2/20 0.39
ACHE P22303 1/20 0.39
CHRM1 P11229 1/20 0.38
NAMPT P43490 1/20 0.38
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 1/20 0.37
GRM1 Q13255 1/20 0.37
MAPK1 P28482 1/20 0.36

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
SCHEMBL4400862 0.85 GPR119 (0.39) GPR119PRKCIACHEHTTATM
SCHEMBL4401573 0.82 GPR119 (0.47) GPR119PRKCIACHENAMPTHTT
SCHEMBL4400858 0.81 GPR119 (0.46) GPR119PRKCIACHENAMPTMEN1
SCHEMBL19068876 0.79 HTT (0.40) ACHEHTTATMMEN1KMT2A
SCHEMBL4399124 0.78 GPR119 (0.46) GPR119PRKCIP2RX7HTTATM
SCHEMBL4401564 0.75 NR1H2 (0.52) GPR119PRKCIP2RX7ACHECHRM1
SCHEMBL4402985 0.75 GPR119 (0.39) GPR119PRKCIACHEPOLBGRM1
SCHEMBL4401576 0.75 POLB (0.39) GPR119ACHEHTTATMMEN1
SCHEMBL14553991 0.74 MGLL (0.43) GPR119HTTATMPOLBMAPK1
SCHEMBL15882223 0.73 NR1H2 (0.40) GPR119ACHECHRM1HTTATM

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
US-8263598-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-11 US disclosed
US-8178535-B2 Substituted sulfonamide compounds having bradykinin 1 receptor activity and use thereof as medicaments GRUENENTHAL GMBH (DE) 2012-05-15 US disclosed
US-20090203672-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-08-13 US disclosed
WO-2009090055-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-07-23 WO disclosed
WO-2009090054-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-07-23 WO disclosed
US-20090186899-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-07-23 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 (2 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-20090186899-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 GPR119 396/4885PRKCI 3084/4885P2RX7 130/4885
US-20090203672-A1 Substituted Sulfonamide Compounds RPS4X, RPS4Y1, CACNA1A GPR119 1047/4885PRKCI 3054/4885P2RX7 221/4885

“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.