SCHEMBL6489234

SCHEMBL6489234

CCOC(=O)CCCOc1cc(C)c2nc(C)n(Cc3nc(-c4ccccc4)oc3C)c2c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 15/20 0.44
▸ PPARA Q07869 14/20 0.44
▸ USP2 O75604 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ FFAR1 O14842 1/20 0.42
▸ PPARD Q03181 1/20 0.42
▸ FAAH O00519 1/20 0.42

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
SCHEMBL6503515 0.91 FFAR1 (0.49) PPARGPPARAUSP2SMN1; SMN2FFAR1
SCHEMBL6492166 0.80 GAA (0.43) SMN1; SMN2FAAH
SCHEMBL6488150 0.79 PLA2G2A (0.42) FAAH
SCHEMBL6498255 0.79 FAAH (0.41) PPARGPPARAPPARDFAAH
SCHEMBL6489154 0.79 ALDH1A1 (0.47) PPARGSMN1; SMN2FAAH
SCHEMBL6488639 0.78 TARBP2 (0.47) PPARGPPARAUSP2SMN1; SMN2PPARD
SCHEMBL6496755 0.77 PDE3B (0.44) FAAH
SCHEMBL6502360 0.77 PABPC1 (0.39) FAAH
SCHEMBL6489292 0.76 MCL1 (0.38) FAAH
SCHEMBL6501772 0.76 PIK3C2B (0.47) FAAH

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 233/4885PPARA 665/4885USP2 4521/4885

“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.

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