SCHEMBL6498744

SCHEMBL6498744

CCCCCOc1ccc(Cn2c(C)nc3ccc(OCCC(=O)O)cc32)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.51
ALOX5AP P20292 2/20 0.42
THRB P10828 3/20 0.40
PLA2G4B P0C869 2/20 0.40
THRA P10827 1/20 0.40
PDE3B Q13370 3/20 0.40
PDE3A Q14432 3/20 0.40
PDE2A O00408 3/20 0.40
P2RX3 P56373 1/20 0.39
P2RY12 Q9H244 1/20 0.39
DCTPP1 Q9H773 1/20 0.39
AGER Q15109 1/20 0.39
MCL1 Q07820 1/20 0.39
PLA2G2A P14555 2/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL6492145 0.96 PPARG (0.51) PPARGALOX5APTHRBPLA2G4BTHRA
SCHEMBL6491422 0.96 PPARG (0.51) PPARGALOX5APTHRBPLA2G4BTHRA
SCHEMBL6500098 0.95 PPARG (0.50) PPARGALOX5APTHRBPLA2G4BTHRA
SCHEMBL6487612 0.93 PPARG (0.51) PPARGALOX5APPLA2G4BMCL1
SCHEMBL6491237 0.90 FFAR1 (0.49) PPARGALOX5APPDE3BPDE3APDE2A
SCHEMBL6301607 0.90 PPARG (0.58) PPARGPLA2G4BTP53
SCHEMBL7199173 0.89 PPARG (0.45) PPARGALOX5APTHRBPLA2G4BTHRA
SCHEMBL6497461 0.89 PPARG (0.49) PPARGALOX5APTHRBTHRAPDE3B
SCHEMBL6500673 0.89 PPARG (0.49) PPARGALOX5APTHRBTHRAPDE3B
SCHEMBL6501485 0.89 PPARG (0.45) PPARGALOX5APTHRBPLA2G4BTHRA

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 1 patent. 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

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 PPARG 233/4885ALOX5AP 4663/4885THRB 2919/4885

“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.