SCHEMBL3567852

SCHEMBL3567852

Cc1ccc(CNS(=O)(=O)c2ccc(C=O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.67
CYP1A2 P05177 1/20 0.67
CYP3A4 P08684 1/20 0.67
ATM Q13315 1/20 0.67
CA9 Q16790 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
CNR2 P34972 1/20 0.65
ALDH1A1 P00352 7/20 0.64
LMNA P02545 4/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
HTT P42858 1/20 0.63
CYP19A1 P11511 1/20 0.60
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
TP53 P04637 1/20 0.54
KDM4E B2RXH2 1/20 0.53
HPGD P15428 2/20 0.53
USP2 O75604 1/20 0.52

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
SCHEMBL25547142 0.88 CA12 (0.83) CA12CYP1A2CYP3A4ATMCA9
SCHEMBL3565089 0.84 ALDH1A1 (0.62) CA12CA9ALDH1A1LMNACYP19A1
SCHEMBL9063058 0.84 ALDH1A1 (0.62) CA12CA9ALDH1A1LMNACYP19A1
SCHEMBL3559019 0.84 KEAP1 (0.71) CA12CYP1A2CYP3A4ATMCA9
SCHEMBL3565797 0.84 ALDH1A1 (0.72) ALDH1A1LMNASMN1; SMN2HTTCYP19A1
SCHEMBL13972835 0.83 CA12 (0.69) CA12CYP1A2CYP3A4ATMCA9
SCHEMBL3564279 0.82 CYP19A1 (0.67) CA12CYP1A2CYP3A4ATMCA9
SCHEMBL17827613 0.82 CA12 (0.73) CA12CYP1A2CYP3A4ATMCA9
SCHEMBL3571824 0.81 SMN1; SMN2 (0.68) CYP1A2CYP3A4L3MBTL1ALDH1A1LMNA
SCHEMBL3925035 0.81 CA12 (0.71) CA12CYP1A2CYP3A4ATMCA9

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687639-B2 Substituted benzimidazoles and imidazo-[4,5]-pyridines JANSSEN PHARMACEUTICA N.V. (BE) 2010-03-30 US disclosed
EP-1613313-B1 2-PHENYL-BENZIMIDAZOL AND 2-PHENYL-IMIDAZO-4,5]-PYRIDINE DERIVATIVES AS CHECKPOINT KINASE CDS1 (CHK2) INHIBITORS FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2007-06-06 EP 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
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 disclosed
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 disclosed
US-20040214857-A1 Substituted benzimidazoles and imidazo-[4,5]-pyridines JANSSEN PHARMACEUTICA, N.V. (BE) 2004-10-28 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 (2 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 CA12 4226/4885CYP1A2 2991/4885CYP3A4 925/4885
US-20040214857-A1 Substituted benzimidazoles and imidazo-[4,5]-pyridines CDK4, CDS2, DDB1 CA12 4269/4885CYP1A2 2824/4885CYP3A4 321/4885

“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.