SCHEMBL6169417

SCHEMBL6169417

CCc1nc2ccc(C(=O)Nc3ccccn3)cc2n1Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PPARG P37231 9/20 0.49
AGTR1 P30556 3/20 0.48
SIRT2 Q8IXJ6 1/20 0.46
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
AGTR2 P50052 2/20 0.45
ACSS2 Q9NR19 1/20 0.43

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
SCHEMBL6168473 0.88 ACSS2 (0.55) PPARGAGTR1AGTR2ACSS2
SCHEMBL6168853 0.86 POLB (0.52) SMN1; SMN2PPARGAGTR1SIRT2AGTR2
SCHEMBL6173780 0.85 LMNA (0.56) NPC1RAB9AKDM4EALDH1A1PPARG
SCHEMBL6170370 0.85 SIRT2 (0.48) MEN1KMT2ANPC1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL7596466 0.84 PPARG (0.54) RAB9APPARGAGTR1AGTR2
SCHEMBL6170724 0.84 NAMPT (0.54) NPC1RAB9AKDM4EALDH1A1PPARG
SCHEMBL6167804 0.83 PPARG (0.66) PPARGAGTR1AGTR2
SCHEMBL6170083 0.83 PPARG (0.47) PPARGAGTR1AGTR2ACSS2
SCHEMBL7593057 0.83 PPARG (0.50) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL6167816 0.81 AGTR1 (0.54) PPARGAGTR1AGTR2ACSS2

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 MEN1 1677/4885KMT2A 1590/4885NPC1 827/4885

“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.