SCHEMBL6498376

SCHEMBL6498376

CCCCCOc1ccc(Cn2c(C)nc3c(C)cc(OC(C)(C)C(=O)O)cc32)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.40
PPARD Q03181 7/20 0.40
PPARG P37231 4/20 0.40
PSEN1 P49768 2/20 0.39
PSEN2 P49810 2/20 0.39
APH1B Q8WW43 2/20 0.39
NCSTN Q92542 2/20 0.39
APH1A Q96BI3 2/20 0.39
PSENEN Q9NZ42 2/20 0.39
ALOX5AP P20292 5/20 0.38
MCL1 Q07820 2/20 0.36
DCTPP1 Q9H773 1/20 0.36

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
SCHEMBL6495893 0.92 PPARA (0.40) PPARAPPARGALOX5APMCL1DCTPP1
SCHEMBL6499263 0.89 ALOX5AP (0.41) PPARAPPARDPPARGALOX5APMCL1
SCHEMBL6490405 0.88 PPARG (0.48) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL6488344 0.87 MCL1 (0.47) PPARGMCL1
SCHEMBL6500130 0.87 DCTPP1 (0.47) PPARGMCL1DCTPP1
SCHEMBL6497730 0.85 PPARG (0.44) PPARGMCL1DCTPP1
SCHEMBL6489066 0.84 PPARG (0.37) PPARAPPARGALOX5APMCL1DCTPP1
SCHEMBL6487942 0.84 MCL1 (0.42) PPARGPSEN1PSEN2APH1BNCSTN
SCHEMBL6488196 0.83 PPARG (0.39) PPARGDCTPP1
SCHEMBL6496934 0.83 MCL1 (0.54) MCL1

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 PPARA 665/4885PPARD 290/4885PPARG 233/4885

“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.