SCHEMBL1160873

SCHEMBL1160873

CCN1Cc2c(Oc3ccc(NS(=O)(=O)c4cccc(Cl)c4)cc3F)ccnc2NC1=O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AXL P30530 6/20 0.43
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
KIT P10721 1/20 0.41
SCN9A Q15858 5/20 0.40
EGFR P00533 6/20 0.39
MET P08581 6/20 0.39
INSR P06213 3/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL11030763 0.91 AXL (0.43) AXLALDH1A1KMT2AKITSCN9A
SCHEMBL11031935 0.91 AXL (0.48) AXLEGFRMETINSR
SCHEMBL11030275 0.90 AXL (0.42) AXLALDH1A1KMT2ASCN9AEGFR
SCHEMBL11027302 0.89 AXL (0.52) AXLEGFRMETINSR
SCHEMBL11032009 0.88 AXL (0.46) AXLALDH1A1SCN9AEGFRMET
SCHEMBL11031202 0.88 AXL (0.40) AXLSCN9AEGFRMET
SCHEMBL11028680 0.87 AXL (0.49) AXLEGFRMET
SCHEMBL12873682 0.86 AXL (0.41) AXLEGFRMET
SCHEMBL1161306 0.86 AXL (0.41) AXLSCN9AEGFRMET
SCHEMBL11028053 0.86 AXL (0.43) AXLALDH1A1KMT2AKITEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569295-B2 Bicyclic urea compounds MERCK PATENT GMBH (DE) 2013-10-29 US disclosed
US-8569295-B2 Bicyclic urea compounds MERCK PATENT GMBH (DE) 2013-10-29 US disclosed
EP-2461869-B1 NOVEL BICYCLIC UREA COMPOUNDS MERCK PATENT GMBH (DE) 2013-08-21 EP disclosed
US-20120190654-A1 NOVEL BICYCLIC UREA COMPOUNDS MERCK PATENT GMBH (DE) 2012-07-26 US disclosed
US-20120190654-A1 NOVEL BICYCLIC UREA COMPOUNDS MERCK PATENT GMBH (DE) 2012-07-26 US disclosed
EP-2461869-A1 NOVEL BICYCLIC UREA COMPOUNDS Merck Patent GmbH (DE) 2012-06-13 EP disclosed
WO-2011017142-A1 NOVEL BICYCLIC UREA COMPOUNDS MERCK PATENT GMBH (DE) 2011-02-10 WO disclosed
WO-2011017142-A1 NOVEL BICYCLIC UREA COMPOUNDS MERCK PATENT GMBH (DE) 2011-02-10 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-20120190654-A1 NOVEL BICYCLIC UREA COMPOUNDS CCNC, CCNI, CCNA1 AXL 1732/4885ALDH1A1 1372/4885KMT2A 708/4885

“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.