SCHEMBL6168741

SCHEMBL6168741

CCCCc1nc2ccc(C(=O)N(C)Cc3ccccn3)cc2n1Cc1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 10/20 0.54
AGTR2 P50052 10/20 0.54
RAB9A P51151 2/20 0.48
MAPT P10636 1/20 0.45
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CNR2 P34972 1/20 0.41

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
SCHEMBL6171098 0.87 AGTR1 (0.55) AGTR1AGTR2RAB9ATP53POLB
SCHEMBL6171102 0.85 AGTR1 (0.54) AGTR1AGTR2RAB9ATP53POLB
SCHEMBL6168974 0.85 PTGES (0.45) AGTR1AGTR2MAPTTP53CNR2
SCHEMBL6171683 0.82 AGTR1 (0.78) AGTR1AGTR2RAB9ATP53POLB
SCHEMBL7671741 0.79 AGTR1 (0.61) AGTR1AGTR2RAB9ATP53POLB
SCHEMBL7675595 0.76 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL6169384 0.75 PDE2A (0.53) AGTR1AGTR2TP53POLB
SCHEMBL6168858 0.73 AGTR1 (0.53) AGTR1AGTR2RAB9AMAPTTP53
SCHEMBL6172390 0.72 PTGES (0.47) AGTR1AGTR2MAPTTP53
SCHEMBL9199340 0.71 AGTR1 (1.00) AGTR1AGTR2RAB9A

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 AGTR1 4001/4885AGTR2 3926/4885RAB9A 3277/4885

“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.