SCHEMBL6171102

SCHEMBL6171102

CCCCc1nc2ccc(C(=O)NCc3ccccn3)cc2n1Cc1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.54
AGTR2 P50052 6/20 0.54
RAB9A P51151 2/20 0.52
POLB P06746 2/20 0.52
TP53 P04637 2/20 0.52
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ROCK2 O75116 1/20 0.47
NPC1 O15118 1/20 0.46
PIK3CA P42336 1/20 0.46
NAMPT P43490 1/20 0.46
PDE2A O00408 1/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL6169384 0.90 PDE2A (0.53) AGTR1AGTR2POLBTP53HPGD
SCHEMBL6168741 0.85 AGTR1 (0.54) AGTR1AGTR2RAB9APOLBTP53
SCHEMBL7674177 0.85 PDE2A (0.55) RAB9APOLBTP53HPGDHSD17B10
SCHEMBL6169466 0.83 KDM4E (0.54) POLBTP53HPGDHSD17B10NPC1
SCHEMBL6168396 0.83 AGTR1 (0.54) AGTR1AGTR2POLBPIK3CANAMPT
SCHEMBL6171683 0.82 AGTR1 (0.78) AGTR1AGTR2RAB9APOLBTP53
SCHEMBL6168869 0.81 TP53 (0.56) POLBTP53HPGDHSD17B10ROCK2
SCHEMBL6171098 0.81 AGTR1 (0.55) AGTR1AGTR2RAB9APOLBTP53
SCHEMBL6169365 0.80 MAPT (0.54) AGTR1AGTR2TP53PIK3CANAMPT
SCHEMBL6171257 0.79 MAPT (0.58) TP53PIK3CANAMPTPDE2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
EP-0882718-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP claimed
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.