SCHEMBL6314907

SCHEMBL6314907

Cc1ccc2[nH]c(N)nc2c1OC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.36
FABP6 P51161 2/20 0.36
PNP P00491 2/20 0.35
MMP12 P39900 1/20 0.34
CDK5 Q00535 4/20 0.33
CDK5R1 Q15078 4/20 0.33
CHEK1 O14757 1/20 0.33
NUDT1 P36639 3/20 0.33
EGLN1 Q9GZT9 1/20 0.32
ULK1 O75385 1/20 0.32
CDK7 P50613 1/20 0.32
PRKCE Q02156 1/20 0.32
CAMK2G Q13555 1/20 0.32
DYRK1A Q13627 1/20 0.32
RPS6KA1 Q15418 1/20 0.32
AAK1 Q2M2I8 1/20 0.32
MAP3K19 Q56UN5 1/20 0.32
CAMKK1 Q8N5S9 1/20 0.32
CAMKK2 Q96RR4 1/20 0.32
ABL1 P00519 1/20 0.31

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
SCHEMBL6315467 0.79 MMP12 (0.36) PARP1FABP6PNPMMP12CDK5
SCHEMBL7416833 0.76 PARP1 (0.57) PARP1
SCHEMBL7408785 0.74 PARP1 (0.57) PARP1
SCHEMBL29728542 0.73 MEN1 (0.43)
SCHEMBL11176777 0.73 NUDT1 (0.43) PARP1CDK5CDK5R1CHEK1NUDT1
SCHEMBL7414714 0.72 PARP1 (0.40) PARP1
SCHEMBL2541920 0.72 CBFB (0.49) FABP6PNPMMP12CDK5CDK5R1
Carbamic Acid SCHEMBL6315736 0.71 RPS6KA3 (0.51) PARP1FABP6PNPMMP12CDK5
Carbamic Acid SCHEMBL6323883 0.71 ALDH1A1 (0.54) PARP1NUDT1
SCHEMBL24112331 0.71 PKMYT1 (0.38) PARP1FABP6PNPMMP12CDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050192328-A1 Compounds and methods for use thereof in the treatment of viral infections UAF TECHNOLOGIES AND RESEARCH, LLC (US) 2005-09-01 US disclosed
US-6900235-B1 Benzimidazole compounds, and pharmaceutical compositions and unit dosages thereof UAF TECHNOLOGIES AND RESEARCH, LLC (US) 2005-05-31 US disclosed
US-6864275-B1 Anticancer agents; viricides UAF TECHNOLOGIES AND RESEARCH, LLC (US) 2005-03-08 US disclosed
US-6710065-B1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CANCER OR A VIRAL INFECTION UAF TECHNOLOGIES AND RESEARCH, LLC 2004-03-23 US disclosed
US-6482843-B1 Compounds and methods for use thereof in the treatment of cancer or viral infections THE PROCTER & GAMBLE COMPANY 2002-11-19 US disclosed
US-6423735-B1 ADMINISTERING BENZIMIDAZOLE COMPOUND THE PROCTER & GAMBLE COMPANY 2002-07-23 US disclosed
US-6423736-B1 ADMINISTERING BENZIMIDAZOLE COMPOUND THE PROCTOR & GAMBLE COMPANY 2002-07-23 US disclosed
US-6420411-B1 BENZIMIDAZOLE DERIVATIVES USED TO TREAT MELANOMA, LEUKEMIA, AND COLON, BREAST, LUNG, PANCREATIC, OVARIAN, AND PROSTATE CANCER; USED TO TREAT HIV; IMPROVED WATER SOLUBILITY THE PROCTER & GAMBLE COMPANY 2002-07-16 US disclosed
US-6407131-B1 5-CARBONYLOXY-1H-BENZIMIDAZOLE-2-CARBAMATE DERIVATIVES THE PROCTER & GAMBLE COMPANY 2002-06-18 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-20050192328-A1 Compounds and methods for use thereof in the treatment of viral infections PAICS, PIGO, BAD PARP1 1133/4885FABP6 1633/4885PNP 136/4885

“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.