SCHEMBL6169488

SCHEMBL6169488

Cc1nc2c(C(=O)NS(=O)(=O)c3ccccc3)cccc2n1Cc1ccc(-c2ccccc2)cc1.[NaH]

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 1/20 0.50
EGFR P00533 1/20 0.48
CCR2 P41597 1/20 0.47
ALDH1A1 P00352 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PPARG P37231 6/20 0.43
BCL2 P10415 3/20 0.43
BCL2L1 Q07817 2/20 0.43
MCL1 Q07820 2/20 0.43
FLT1 P17948 1/20 0.43
FLT4 P35916 1/20 0.43
KDR P35968 1/20 0.43
PTGS1 P23219 1/20 0.42
PTGS2 P35354 1/20 0.42
KDM4E B2RXH2 1/20 0.42
KLKB1 P03952 1/20 0.42
KLK1 P06870 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
SCHEMBL1160343 0.99 AGTR2 (0.51) AGTR2EGFRCCR2ALDH1A1HDAC1
SCHEMBL1160410 0.93 EGFR (0.53) AGTR2EGFRCCR2ALDH1A1HDAC1
SCHEMBL1159792 0.90 AGTR2 (0.49) AGTR2EGFRCCR2ALDH1A1PPARG
SCHEMBL1160133 0.88 AGTR2 (0.49) AGTR2EGFRCCR2PPARGBCL2
SCHEMBL1160363 0.87 PPARG (0.59) AGTR2EGFRCCR2PPARG
SCHEMBL1160145 0.87 AGTR2 (0.54) AGTR2EGFRCCR2PPARG
SCHEMBL1178182 0.87 AGTR2 (0.49) AGTR2EGFRCCR2ALDH1A1PPARG
SCHEMBL1160356 0.87 AGTR2 (0.49) AGTR2EGFRCCR2PPARGBCL2
SCHEMBL1160121 0.87 AGTR2 (0.49) AGTR2EGFRCCR2PPARGBCL2
SCHEMBL1160102 0.87 AGTR2 (0.49) AGTR2EGFRCCR2PPARGBCL2

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 AGTR2 3926/4885EGFR 3576/4885CCR2 4735/4885

“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.