SCHEMBL6168664

SCHEMBL6168664

CCOC(=O)c1ccc2nc(C)n(Cc3ccc([N+](=O)[O-])cc3)c2c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
KCNJ1 P48048 1/20 0.51
KCNH2 Q12809 1/20 0.51
MAOB P27338 1/20 0.49
DCTPP1 Q9H773 2/20 0.48
KDM4E B2RXH2 1/20 0.48
POLB P06746 2/20 0.48
AR P10275 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GSK3B P49841 1/20 0.46
JMJD7 P0C870 1/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 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
SCHEMBL6309555 0.87 PPARG (0.49) LMNAMEN1KMT2ADCTPP1KDM4E
SCHEMBL6172093 0.85 LMNA (0.51) LMNAMEN1KMT2ADCTPP1KDM4E
SCHEMBL6169424 0.85 TNF (0.56) LMNAKDM4EPOLBL3MBTL1HDAC1
SCHEMBL6172139 0.84 DCTPP1 (0.60) LMNAMEN1KMT2AMAOBDCTPP1
SCHEMBL6168941 0.83 PDE2A (0.56) HDAC1HDAC6
SCHEMBL6171722 0.83 PPARG (0.54) LMNADCTPP1KDM4EHTTL3MBTL1
SCHEMBL6168644 0.83 HDAC1 (0.49) LMNAMEN1KMT2ADCTPP1KDM4E
SCHEMBL6169712 0.83 HDAC1 (0.52) MEN1KMT2AHDAC1HDAC6
SCHEMBL6170856 0.83 HDAC1 (0.52) MEN1KMT2AKDM4EL3MBTL1HDAC1
SCHEMBL6169427 0.82 RAB9A (0.49) MEN1KMT2AMAOBKDM4EHDAC1

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 LMNA 225/4885MEN1 1677/4885KMT2A 1590/4885

“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.