SCHEMBL6168869

SCHEMBL6168869

CCc1nc2ccc(C(=O)NCc3ccccn3)cc2n1Cc1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.56
PDE2A O00408 1/20 0.56
KDM4E B2RXH2 2/20 0.53
TDP1 Q9NUW8 2/20 0.51
PIK3CA P42336 1/20 0.49
NAMPT P43490 1/20 0.48
ROCK2 O75116 1/20 0.47
ALDH1A1 P00352 3/20 0.46
PKM P14618 2/20 0.46
CASP6 P55212 1/20 0.46
DGAT2 Q96PD7 1/20 0.46
POLB P06746 2/20 0.46
HPGD P15428 2/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
ALOX15 P16050 1/20 0.45
NR4A1 P22736 1/20 0.45
APEX1 P27695 1/20 0.45

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
SCHEMBL7674177 0.93 PDE2A (0.55) TP53PDE2AKDM4ETDP1PIK3CA
SCHEMBL6169384 0.91 PDE2A (0.53) TP53PDE2AKDM4ETDP1PIK3CA
SCHEMBL6168600 0.89 PDE2A (0.60) TP53PDE2AKDM4ETDP1PIK3CA
SCHEMBL6172751 0.86 TP53 (0.55) TP53PDE2AKDM4ETDP1PIK3CA
SCHEMBL6173780 0.86 LMNA (0.56) TP53PDE2AKDM4ETDP1PIK3CA
SCHEMBL6168534 0.85 PDE2A (0.53) TP53PDE2AKDM4ETDP1PIK3CA
SCHEMBL6170736 0.83 RAB9A (0.53) TP53PDE2AKDM4ETDP1PIK3CA
SCHEMBL6172013 0.82 TP53 (0.57) TP53KDM4ETDP1ROCK2ALDH1A1
SCHEMBL6168396 0.82 AGTR1 (0.54) PDE2AKDM4ETDP1PIK3CANAMPT
SCHEMBL6169365 0.81 MAPT (0.54) TP53PDE2AKDM4EPIK3CANAMPT

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 TP53 19/4885PDE2A 3774/4885KDM4E 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.