SCHEMBL2525194

SCHEMBL2525194

O=C(NC1N=C(Cl)c2ccccc2N(c2ccccc2)C1=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SENP1 Q9P0U3 3/20 0.55
CCKBR P32239 3/20 0.48
BRD4 O60885 9/20 0.48
BRD2 P25440 9/20 0.48
BRD3 Q15059 9/20 0.48
SCN9A Q15858 1/20 0.47
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
HSD17B10 Q99714 1/20 0.42
P2RX7 Q99572 1/20 0.41

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
SCHEMBL6005691 0.87 SENP1 (0.63) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL6006456 0.86 SENP1 (0.52) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL6006704 0.86 SENP1 (0.59) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL6003842 0.82 BRD4 (0.68) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL6005238 0.79 SENP1 (0.56) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL15628273 0.77 SENP1 (0.62) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL16979057 0.75 SENP1 (0.66) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL15622216 0.75 SENP1 (0.66) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL9256442 0.75 SCN9A (0.61) SENP1CCKBRBRD4BRD2BRD3
SCHEMBL9256454 0.75 SCN9A (0.61) SENP1CCKBRBRD4BRD2BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039616-B2 Benzodiazepine derivatives for treating hepatitis C infection ASTRAZENECA AB (SE) 2011-10-18 US disclosed
US-20090318427-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING HEPATITIS C INFECTION ARROW THERAPEUTICS LIMITED (GB) 2009-12-24 US disclosed
EP-1928465-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING HEPATITIS C INFECTION Arrow Therapeutics Limited (GB) 2008-06-11 EP disclosed
WO-2007034127-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING HEPATITIS C INFECTION ARROW THERAPEUTICS LIMITED (GB) 2007-03-29 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 (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-20090318427-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING HEPATITIS C INFECTION CNR1, GABRA6, SIGMAR1 SENP1 3741/4885CCKBR 170/4885BRD4 482/4885

“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.