SCHEMBL2581454

SCHEMBL2581454

CC(=O)Nc1nonc1-c1nc2ccccc2n1CC(=O)c1ccc(Cl)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.69
ALDH1A1 P00352 8/20 0.69
HTT P42858 6/20 0.69
HPGD P15428 4/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
HSD17B10 Q99714 7/20 0.64
MAPT P10636 4/20 0.64
TSHR P16473 4/20 0.64
TP53 P04637 3/20 0.64
NPSR1 Q6W5P4 1/20 0.64
POLB P06746 3/20 0.62
MAPK1 P28482 2/20 0.59
ESR2 Q92731 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
CXCR3 P49682 1/20 0.57
CTSD P07339 1/20 0.56

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
SCHEMBL2575692 0.90 CTSD (0.58) KDM4EALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL2582149 0.84 TSHR (0.57) KDM4EALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL2578815 0.84 CTSD (0.51) KDM4EALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL1385523 0.83 KDM4E (0.71) KDM4EALDH1A1HTTSMN1; SMN2MAPT
SCHEMBL1384956 0.83 ALDH1A1 (0.56) KDM4EALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL2583244 0.82 CTSD (0.58) KDM4EALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL20887162 0.80 KDM4E (0.88) KDM4EALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL1160486 0.80 KDM4E (0.58) KDM4EALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL2582550 0.80 ALDH1A1 (0.64) KDM4EALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL5037413 0.79 KDM4E (0.62) KDM4EALDH1A1HTTHPGDSMN1; SMN2

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636215-B1 FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2008-01-23 EP claimed
US-10724072-B2 Use of phospho-Akt as a biomarker of drug response BASILEA PHARMACEUTICA AG (CH) 2020-07-28 US disclosed
US-10656162-B2 Use of glu-tubulin as a biomarker of drug response to furazanobenzimidazoles BASILEA PHARMACEUTICA AG (CH) 2020-05-19 US disclosed
US-10222377-B2 Use of BUBR1 as a biomarker of drug response to furazanobenzimidazoles BASILEA PHARMACEUTICA AG (CH) 2019-03-05 US disclosed
US-20190010536-A1 USE OF PHOSPHO-AKT AS A BIOMARKER OF DRUG RESPONSE BASILEA PHARMACEUTICA AG (CH) 2019-01-10 US disclosed
US-20180364254-A1 USE OF GLU-TUBULIN AS A BIOMARKER OF DRUG RESPONSE TO FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG 2018-12-20 US disclosed
US-10067120-B2 Use of acetylated tubulin as a biomarker of drug response to furazanobenzimidazoles BASILEA PHARMACEUTICA AG (CH) 2018-09-04 US disclosed
US-10006078-B2 Use of phospho-Akt as a biomarker of drug response BASILEA PHARMACEUTICA AG (CH) 2018-06-26 US disclosed
US-9995754-B2 Use of glu-tubulin as a biomarker of drug response to furazanobenzimidazoles BASILEA PHARMACEUTICA AG (CH) 2018-06-12 US disclosed
US-9970938-B2 Use of BUBR1 as a biomarker of drug response to furazanobenzimidazoles BASILEA PHARMACEUTICA AG (CH) 2018-05-15 US disclosed
WO-2012113802-A1 USE OF ACETYLATED TUBULIN AS A BIOMARKER OF DRUG RESPONSE TO FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2012-08-30 WO disclosed
WO-2012098207-A1 USE OF BUBR1 AS A BIOMARKER OF DRUG RESPONSE TO FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2012-07-26 WO disclosed
WO-2012098208-A1 USE OF STATHMIN AS A BIOMARKER OF DRUG RESPONSE TO FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2012-07-26 WO disclosed
WO-2012098203-A1 USE OF GLU-TUBULIN AS A BIOMARKER OF DRUG RESPONSE TO FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2012-07-26 WO disclosed
US-RE42890-E1 Furazanobenzimidazoles BASILEA PHARMACEUTICA AG (CH) 2011-11-01 US disclosed
US-7385061-B2 4-[1-(6-amino-3-pyridylcarbonylmethyl)-1H-benzimidazol-2-yl]-furazan-3-yl]-N-(2-cyanoethyl)-amine; treatment of neoplastic and autoimmune diseases BASILEA PHARMACEUTICA AG (CH) 2008-06-10 US disclosed
EP-1636215-B1 FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2008-01-23 EP disclosed
US-20070043061-A1 Furazanobenzimidazoles BASILEA PHARMACEUTICA AG 2007-02-22 US disclosed
EP-1636215-A1 FURAZANOBENZIMIDAZOLES Basilea Pharmaceutica AG (CH) 2006-03-22 EP disclosed
WO-2004103994-A1 FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2004-12-02 WO 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 (8 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-10724072-B2 Use of phospho-Akt as a biomarker of drug response AKT3, AKT1S1, AKT2 KDM4E 3884/4885ALDH1A1 4829/4885HTT 3440/4885
US-10656162-B2 Use of glu-tubulin as a biomarker of drug response to furazanobenzimidazoles TUBB, TUBB1, TUBB6 KDM4E 4206/4885ALDH1A1 1153/4885HTT 2608/4885
US-20180364254-A1 USE OF GLU-TUBULIN AS A BIOMARKER OF DRUG RESPONSE TO FURAZANOBENZIMIDAZOLES TUBB, TUBB1, TUBB6 KDM4E 4206/4885ALDH1A1 1153/4885HTT 2608/4885
US-20190010536-A1 USE OF PHOSPHO-AKT AS A BIOMARKER OF DRUG RESPONSE AKT3, AKT1S1, AKT2 KDM4E 3884/4885ALDH1A1 4829/4885HTT 3440/4885
US-10067120-B2 Use of acetylated tubulin as a biomarker of drug response to furazanobenzimidazoles TUBB1, TUBB, TUBB6 KDM4E 3837/4885ALDH1A1 595/4885HTT 2770/4885
US-10222377-B2 Use of BUBR1 as a biomarker of drug response to furazanobenzimidazoles BUB1B, BUB1, BUB3 KDM4E 2211/4885ALDH1A1 1640/4885HTT 4803/4885
US-10006078-B2 Use of phospho-Akt as a biomarker of drug response AKT3, AKT2, AKT1S1 KDM4E 4613/4885ALDH1A1 4762/4885HTT 3335/4885
US-20070043061-A1 Furazanobenzimidazoles FOXO1, CYP2F1, OXER1 KDM4E 1039/4885ALDH1A1 335/4885HTT 4605/4885

“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.