SCHEMBL948735

SCHEMBL948735

Cc1cccc2nc(C3CCN(C(=O)OC(C)(C)C)CC3)cn12

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.49
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
HTT P42858 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TSHR P16473 1/20 0.45
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
NAMPT P43490 1/20 0.43
TRPV3 Q8NET8 1/20 0.43

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
SCHEMBL25237958 0.81 GPR119 (0.49) GPR119KDM4EALDH1A1HPGDHTT
SCHEMBL20140593 0.80 HTR1A (0.54) GPR119KDM4EHTTMAPTTHRB
SCHEMBL275976 0.77 GPR119 (0.49) GPR119KDM4EHTTMEN1KMT2A
SCHEMBL16291592 0.77 GPR119 (0.50) GPR119KDM4EALDH1A1HPGDHTT
SCHEMBL29518419 0.77 GPR119 (0.50) GPR119KDM4EALDH1A1HPGDHTT
SCHEMBL10324303 0.77 TRPV3 (0.52) GPR119KDM4EHTTMAPTTHRB
SCHEMBL31192638 0.77 TRPV3 (0.52) GPR119KDM4EHTTMAPTTHRB
SCHEMBL948301 0.76 GPR119 (0.48) GPR119KDM4EMEN1KMT2AMAPT
SCHEMBL20266403 0.76 STS (0.51) GPR119KDM4EHPGDMEN1KMT2A
SCHEMBL14240648 0.76 TRPV3 (0.51) GPR119KDM4EALDH1A1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20070004736-A1 Imidazole derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-04 US disclosed
EP-1564213-A1 IMIDAZOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-08-17 EP 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-20070004736-A1 Imidazole derivative, process for producing the same, and use HRH4, F2, HRH2 GPR119 1327/4885KDM4E 1356/4885ALDH1A1 2246/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 GPR119 1118/4885KDM4E 1558/4885ALDH1A1 2316/4885

“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.