SCHEMBL948610

SCHEMBL948610

Cc1ncn(C2CCN(C(=O)OC(C)(C)C)CC2)c1C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.54
GPR119 Q8TDV5 9/20 0.50
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
CTSD P07339 1/20 0.45
CTSE P14091 1/20 0.45
BACE1 P56817 1/20 0.45
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL947678 0.79 GPR119 (0.50) HCAR1GPR119KDM4EMAPTTHRB
SCHEMBL27035854 0.79 HCAR1 (0.49) HCAR1GPR119KDM4EMAPTTHRB
SCHEMBL948139 0.79 GPR119 (0.53) HCAR1GPR119KDM4EMAPTTHRB
SCHEMBL948286 0.78 FAAH (0.49) GPR119KDM4EMAPTTHRBBACE1
SCHEMBL6246964 0.78 HCAR1 (0.59) HCAR1GPR119CTSDCTSEBACE1
SCHEMBL948019 0.76 GPR119 (0.54) HCAR1GPR119KDM4EMAPTTHRB
SCHEMBL16400559 0.76 GPR119 (0.50) HCAR1GPR119KDM4EMAPTTHRB
SCHEMBL23930830 0.76 HCAR1 (0.49) HCAR1GPR119MAPTTHRBCTSD
SCHEMBL3516021 0.76 ADORA2A (0.60)
SCHEMBL21880090 0.76 ALDH1A1 (0.48) HCAR1GPR119MAPTTP53HPGD

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 HCAR1 130/4885GPR119 1327/4885KDM4E 1356/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 HCAR1 215/4885GPR119 1118/4885KDM4E 1558/4885

“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.