SCHEMBL6169652

SCHEMBL6169652

CCc1nc2ccc(C(=O)Nc3nncs3)cc2n1Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.47
AGTR1 P30556 3/20 0.46
KDM4E B2RXH2 1/20 0.45
AGTR2 P50052 2/20 0.43
PTGES O14684 1/20 0.42
MAPT P10636 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
SCHEMBL6170370 0.86 SIRT2 (0.48) PPARGAGTR1MAPT
SCHEMBL6168473 0.85 ACSS2 (0.55) PPARGAGTR1AGTR2PTGESMAPT
SCHEMBL6169764 0.82 PPARG (0.48) PPARGAGTR1AGTR2
Hydrochloric Acid SCHEMBL7596466 0.82 PPARG (0.54) PPARGAGTR1AGTR2
SCHEMBL6168853 0.82 POLB (0.52) PPARGAGTR1AGTR2PTGESMAPT
SCHEMBL6169417 0.81 MEN1 (0.53) PPARGAGTR1KDM4EAGTR2
SCHEMBL6167804 0.81 PPARG (0.66) PPARGAGTR1AGTR2
SCHEMBL6170083 0.81 PPARG (0.47) PPARGAGTR1AGTR2
SCHEMBL6170724 0.80 NAMPT (0.54) PPARGAGTR1KDM4EMAPT
SCHEMBL6167816 0.79 AGTR1 (0.54) PPARGAGTR1AGTR2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882718-B1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-08-31 EP disclosed
US-20020082280-A1 Method of inhibiting neoplastic cells with benzimidazole derivatives OSI PHARMACEUTICALS, INC. 2002-06-27 US disclosed
US-6352985-B1 CARDIOVASCULAR DISORDERS OR GASTROINTESTINAL DISORDERS, DIABETES (TYPE II DIABETES), DIABETIC COMPLICATIONS METHOD FOR LOWERING THE BLOOD SUGAR LEVEL OF A PATIENT, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-05 US disclosed
US-6348032-B1 POTENT COMPOUNDS THAT INDUCE APOPTOSIS IN NEOPLASTIC CELLS (BUT NOT SUBSTANTIALLY IN NORMAL CELLS), WITHOUT SUBSTANTIALLY INHIBITING PGE-2. CELL PATHWAYS, INC. 2002-02-19 US disclosed
US-6166219-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-0882718-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 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-20020082280-A1 Method of inhibiting neoplastic cells with benzimidazole derivatives MKI67, CCNI, TMBIM6 PPARG 1181/4885AGTR1 4001/4885KDM4E 2132/4885

“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.