SCHEMBL1577532

SCHEMBL1577532

Cc1cc(C2CCN(C(=O)O)CC2)cnc1COc1ccc(S(C)(=O)=O)cc1Br

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.42
GPR119 Q8TDV5 3/20 0.38
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
PRMT5 O14744 3/20 0.34
FASN P49327 2/20 0.34
CYP2C9 P11712 1/20 0.34
DRD2 P14416 1/20 0.34
SLC6A9 P48067 2/20 0.34
THRB P10828 1/20 0.34
BRD4 O60885 2/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL1577687 0.92 ALDH1A1 (0.40) GPR119NPC1RAB9AKMT2APRMT5
SCHEMBL1577759 0.89 DPP4 (0.42) DPP4GPR119NPC1RAB9AKMT2A
SCHEMBL1577293 0.86 DPP4 (0.41) DPP4GPR119DRD2SLC6A9THRB
SCHEMBL1577511 0.86 GPR119 (0.46) GPR119PRMT5FASN
SCHEMBL1577940 0.80 ALDH1A1 (0.40) GPR119NPC1LMNA
SCHEMBL1577553 0.78 GPR119 (0.44) GPR119NPC1RAB9APRMT5LMNA
SCHEMBL1577799 0.77 GPR119 (0.46) GPR119PRMT5
SCHEMBL1577922 0.77 GPR119 (0.45) GPR119NPC1RAB9APRMT5
SCHEMBL1577390 0.77 GPR119 (0.45) GPR119PRMT5
SCHEMBL10179554 0.76 GPR119 (0.45) GPR119

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-20140018537-A1 GPR119 AGONIST NIPPON CHEMIPHAR CO., LTD. (JP) 2014-01-16 US disclosed
US-8536176-B2 GPR119 agonist NIPPON CHEMIPHAR CO., LTD. (JP) 2013-09-17 US disclosed
US-20110137032-A1 GPR119 AGONIST NIPPON CHEMIPHAR CO., LTD. (JP) 2011-06-09 US disclosed
EP-2311822-A1 GPR119 AGONIST Nippon Chemiphar Co., Ltd. (JP) 2011-04-20 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-20140018537-A1 GPR119 AGONIST GPR119, GPR27, GPR52 DPP4 3309/4885GPR119 1/4885NPC1 3200/4885
US-20110137032-A1 GPR119 AGONIST GPR119, GPR27, GPR52 DPP4 3309/4885GPR119 1/4885NPC1 3200/4885

“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.