SCHEMBL6168481

SCHEMBL6168481

Cn1cnc2cc(C(=O)NCc3ccccn3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
NAMPT P43490 3/20 0.57
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
POLB P06746 2/20 0.55
HPGD P15428 2/20 0.55
HSD17B10 Q99714 2/20 0.55
ALDH1A1 P00352 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPT P10636 1/20 0.55
THRB P10828 1/20 0.55
PKM P14618 1/20 0.55
ALOX15 P16050 1/20 0.55
NR4A1 P22736 1/20 0.55
APEX1 P27695 1/20 0.55
CASP1 P29466 1/20 0.55
PTPN7 P35236 1/20 0.55
RECQL P46063 1/20 0.55
BLM P54132 1/20 0.55
CASP7 P55210 1/20 0.55

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
SCHEMBL16082510 0.81 TP53 (0.72) KDM4EMEN1KMT2AHPGDALDH1A1
SCHEMBL7982093 0.80 NAMPT (0.57) NAMPTMEN1KMT2AHPGDALDH1A1
SCHEMBL30274434 0.80 NAMPT (0.64) KDM4ENAMPTMEN1KMT2AALDH1A1
SCHEMBL26581281 0.80 KDM4E (0.61) KDM4ENAMPTMEN1KMT2APOLB
SCHEMBL15174980 0.78 KDM4E (0.45) KDM4ENAMPTMEN1KMT2APOLB
SCHEMBL6112673 0.77 NAMPT (0.54) NAMPTMEN1KMT2APOLBHPGD
SCHEMBL13947279 0.76 KDM4E (0.79) KDM4ENAMPTMEN1KMT2APOLB
SCHEMBL7596545 0.76 NAMPT (0.54) KDM4ENAMPTMEN1KMT2APOLB
SCHEMBL6169101 0.76 KDM4E (0.59) KDM4ENAMPTMEN1KMT2APOLB
SCHEMBL8360112 0.76 NAMPT (0.61) NAMPTMEN1KMT2AHPGDALDH1A1

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 KDM4E 2132/4885NAMPT 123/4885MEN1 1677/4885

“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.