SCHEMBL13879477

SCHEMBL13879477

O=C1NC(Cc2c[nH]cn2)C(=O)N1c1ccccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.37
MGLL Q99685 1/20 0.37
ROCK2 O75116 1/20 0.35
ALOX5 P09917 2/20 0.34
NPSR1 Q6W5P4 1/20 0.33
TNF P01375 1/20 0.33
UBE2N P61088 1/20 0.33

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
SCHEMBL10612824 0.83 MAPT (0.39) RIPK1NPSR1
SCHEMBL13879561 0.82 MGLL (0.41) MGLLNPSR1
SCHEMBL13879483 0.82 GAA (0.47) NPSR1UBE2N
SCHEMBL13879399 0.80 NPSR1 (0.39) RIPK1MGLLNPSR1TNFUBE2N
SCHEMBL13879499 0.80 MGLL (0.38) RIPK1MGLLNPSR1UBE2N
SCHEMBL13879566 0.79 NPSR1 (0.33) RIPK1NPSR1TNFUBE2N
SCHEMBL13879362 0.76 HSD17B10 (0.34) NPSR1UBE2N
SCHEMBL13879540 0.75 KMT2A (0.55) TNF
SCHEMBL13879575 0.74 KDM4E (0.42) MGLLROCK2ALOX5
SCHEMBL13879564 0.73 NPSR1 (0.47) MGLLROCK2NPSR1TNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
WO-2007047146-A2 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. (US) 2007-04-26 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-20090099186-A1 INHIBITORS OF VIRAL REPLICATION EIF2AK2, HAVCR2, RTF2 RIPK1 3413/4885MGLL 2140/4885ROCK2 1477/4885

“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.