SCHEMBL11028053

SCHEMBL11028053

CCN1Cc2c(Oc3ccc(NS(=O)(=O)c4ccc(OC)cc4)cc3F)ccnc2NC1=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AXL P30530 6/20 0.43
HPGD P15428 1/20 0.43
BRD4 O60885 1/20 0.43
MET P08581 3/20 0.41
KIT P10721 3/20 0.41
EGFR P00533 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PLA2G7 Q13093 1/20 0.39
ESR1 P03372 1/20 0.39
TRIM24 O15164 1/20 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
SCHEMBL11032009 0.93 AXL (0.46) AXLHPGDBRD4METEGFR
SCHEMBL12873682 0.91 AXL (0.41) AXLMETEGFRPLA2G7
SCHEMBL1161306 0.91 AXL (0.41) AXLMETEGFRPLA2G7
SCHEMBL11030763 0.91 AXL (0.43) AXLHPGDMETKITMEN1
SCHEMBL11031935 0.91 AXL (0.48) AXLBRD4METEGFRPLA2G7
SCHEMBL11030275 0.90 AXL (0.42) AXLMETEGFRMEN1ALDH1A1
SCHEMBL11031202 0.89 AXL (0.40) AXLMETEGFR
SCHEMBL11888328 0.89 AXL (0.39) AXLMETEGFRPLA2G7
SCHEMBL1160873 0.86 AXL (0.43) AXLMETKITEGFRALDH1A1
SCHEMBL1160763 0.86 AXL (0.43) AXLHPGDBRD4METEGFR

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 6 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
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 1732/4885HPGD 1182/4885BRD4 158/4885

“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.