SCHEMBL6488960

SCHEMBL6488960

CCCCCOc1ccc(Cn2c(OCC)nc3c(C)cc(-c4cccc(C(=O)O)c4)cc32)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 0.44
NR1H4 Q96RI1 4/20 0.42
AGTR1 P30556 2/20 0.40
PLA2G4B P0C869 1/20 0.40
EDNRA P25101 1/20 0.37
PIN1 Q13526 1/20 0.37
PLA2G4A P47712 1/20 0.37

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
SCHEMBL6488938 0.94 PTPN11 (0.37) PTPN11NR1H4AGTR1
SCHEMBL6495250 0.92 RARB (0.45) PTPN11AGTR1PLA2G4BPIN1PLA2G4A
SCHEMBL6497678 0.91 PTPN11 (0.46) PTPN11NR1H4PLA2G4BEDNRAPIN1
SCHEMBL6488966 0.87 RXRA (0.41) NR1H4
SCHEMBL6490173 0.83 RARB (0.47) PTPN11PLA2G4BPIN1PLA2G4A
SCHEMBL6498090 0.83 MCL1 (0.45) PLA2G4B
SCHEMBL6488487 0.81 PDE2A (0.39) AGTR1
SCHEMBL6489678 0.81 MCL1 (0.41)
SCHEMBL6497730 0.80 PPARG (0.44) PTPN11PLA2G4BPLA2G4A
SCHEMBL6498192 0.79 RXRA (0.43) NR1H4

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-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO 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-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD PTPN11 2297/4885NR1H4 1441/4885AGTR1 2045/4885

“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.