SCHEMBL11032445

SCHEMBL11032445

CCN1Cc2c(Oc3ccc(NS(=O)(=O)c4cc(Br)ccc4OC)cc3F)ccnc2NC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 13/20 0.43
BRD4 O60885 2/20 0.42
BRD2 P25440 1/20 0.42
ALPL P05186 3/20 0.42
BRAF P15056 1/20 0.41
PLK4 O00444 1/20 0.41
AURKA O14965 1/20 0.41
GAK O14976 1/20 0.41
RIPK2 O43353 1/20 0.41
PRKAB2 O43741 1/20 0.41
ERN1 O75460 1/20 0.41
STK10 O94804 1/20 0.41
MAP4K4 O95819 1/20 0.41
EGFR P00533 1/20 0.41
FYN P06241 1/20 0.41
YES1 P07947 1/20 0.41
LYN P07948 1/20 0.41
MET P08581 1/20 0.41
SRC P12931 1/20 0.41
FER P16591 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
SCHEMBL11028680 0.91 AXL (0.49) AXLBRD4ALPLBRAFPLK4
SCHEMBL1161306 0.89 AXL (0.41) AXLPLK4AURKAGAKRIPK2
SCHEMBL11028053 0.85 AXL (0.43) AXLBRD4EGFRMETTRIM24
SCHEMBL11028985 0.85 MST1R (0.48) AXLBRD4BRD2ALPLTRIM24
SCHEMBL11032009 0.84 AXL (0.46) AXLBRD4BRAFPLK4AURKA
SCHEMBL11031202 0.84 AXL (0.40) AXLBRAFPLK4AURKAGAK
SCHEMBL11031935 0.84 AXL (0.48) AXLBRD4BRAFPLK4AURKA
SCHEMBL11030275 0.83 AXL (0.42) AXLEGFRMET
SCHEMBL11030763 0.83 AXL (0.43) AXLMET
SCHEMBL12873682 0.83 AXL (0.41) AXLBRAFPLK4AURKAGAK

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 5 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
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 1732/4885BRD4 158/4885BRD2 135/4885

“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.