SCHEMBL1379281

SCHEMBL1379281

O=S(=O)(NCc1ccco1)c1ccc(-c2nc3ccccc3[nH]2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 4/20 0.71
KMT2A Q03164 6/20 0.57
KDM4E B2RXH2 7/20 0.52
MAPT P10636 6/20 0.52
SMN1; SMN2 Q16637 5/20 0.52
HSD17B10 Q99714 5/20 0.52
MEN1 O00255 5/20 0.52
POLB P06746 4/20 0.52
TSHR P16473 3/20 0.52
USP2 O75604 2/20 0.52
GAA P10253 2/20 0.51
RAB9A P51151 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
HPGD P15428 2/20 0.50
NPC1 O15118 1/20 0.50
TP53 P04637 1/20 0.50
ALDH1A1 P00352 9/20 0.48
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL3563322 0.83 CHEK2 (0.86) CHEK2KMT2AMEN1POLBTDP1
SCHEMBL3564516 0.80 CHEK2 (0.71) CHEK2KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL3571725 0.80 CHEK2 (0.68) CHEK2KDM4ESMN1; SMN2GAARAB9A
SCHEMBL3562499 0.79 CHEK2 (0.68) CHEK2KDM4EMAPTSMN1; SMN2GAA
SCHEMBL3560900 0.79 CHEK2 (0.68) CHEK2KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL3571768 0.76 CHEK2 (0.71) CHEK2KDM4EMAPTSMN1; SMN2GAA
SCHEMBL3574951 0.76 CHEK2 (0.73) CHEK2MAPTSMN1; SMN2POLBGAA
SCHEMBL3568934 0.76 CHEK2 (0.70) CHEK2KDM4EMAPTSMN1; SMN2TSHR
SCHEMBL28221694 0.75 KMT2A (0.68) KMT2AKDM4EMAPTSMN1; SMN2HSD17B10
SCHEMBL25248439 0.71 KMT2A (0.68) KMT2AKDM4EMAPTSMN1; SMN2HSD17B10

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
JP-4726235-B2 2011-07-20 JP claimed
EP-1613313-A1 2-PHENYL-BENZIMIDAZOL AND 2-PHENYL-IMIDAZO-4,5!-PYRIDINE DERIVATIVES AS CHECKPOINT KINASE CDS1 (CHK2) INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA N.V. (BE) 2006-01-11 EP claimed
WO-2004093873-A1 2-PHENYL-BENZIMIDAZOL AND 2-PHENYL-IMIDAZO-`4,5!-PYRIDINE DERIVATIVES AS CHECKPOINT KINASE CDS1 (CHK2) INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA, N.V. (BE) 2004-11-04 WO claimed
US-7687639-B2 Substituted benzimidazoles and imidazo-[4,5]-pyridines JANSSEN PHARMACEUTICA N.V. (BE) 2010-03-30 US disclosed
US-20060252793-A1 Substituted benzimidazoles and imidazo-[4,5]-pyridines BW CONVERTING AB (SE) 2006-11-09 US disclosed
US-7132440-B2 Substituted benzimidazoles and imidazo-[4,5]-pyridines JANSSEN PHARMACEUTICA, N.V. (BE) 2006-11-07 US 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-20060252793-A1 Substituted benzimidazoles and imidazo-[4,5]-pyridines CDKN1A, DDB1, TMBIM6 CHEK2 14/4885KMT2A 4404/4885KDM4E 3815/4885

“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.