SCHEMBL3499330

SCHEMBL3499330

COC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)c1cn2cccc(OCc3ccc(Cl)cc3)c2n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.47
GPR34 Q9UPC5 1/20 0.46
RAB9A P51151 2/20 0.46
GAA P10253 1/20 0.46
PTPN1 P18031 1/20 0.45
LTA4H P09960 1/20 0.44
YAP1 P46937 7/20 0.44
CDK2 P24941 3/20 0.44
PYGL P06737 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
ERAP2 Q6P179 1/20 0.43
LNPEP Q9UIQ6 1/20 0.43
NOS2 P35228 1/20 0.42
NPC1 O15118 1/20 0.41

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
SCHEMBL3499328 1.00 PPARG (0.47) PPARGGPR34RAB9AGAAPTPN1
SCHEMBL3498741 0.93 GPR34 (0.54) PPARGGPR34PTPN1
SCHEMBL3498742 0.93 GPR34 (0.54) PPARGGPR34PTPN1
SCHEMBL3499004 0.83 GPR34 (0.52) PPARGGPR34RAB9AGAAPTPN1
SCHEMBL3499002 0.83 GPR34 (0.52) PPARGGPR34RAB9AGAAPTPN1
SCHEMBL3497393 0.83 GPR34 (0.55) PPARGGPR34RAB9AGAAPTPN1
SCHEMBL3497391 0.83 GPR34 (0.55) PPARGGPR34RAB9AGAAPTPN1
SCHEMBL3497029 0.83 GPR34 (0.53) PPARGGPR34RAB9AGAAPTPN1
SCHEMBL3497026 0.83 GPR34 (0.53) PPARGGPR34RAB9AGAAPTPN1
SCHEMBL3500045 0.82 GPR34 (0.51) PPARGGPR34RAB9AGAAPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 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 (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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 PPARG 189/4885GPR34 1/4885RAB9A 2269/4885

“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.