SCHEMBL9905427

SCHEMBL9905427

CCN1Cc2c(Oc3ccc(C(N)=O)cc3F)ccnc2NC1=O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MST1R Q04912 2/20 0.39
OPRM1 P35372 5/20 0.38
OPRD1 P41143 5/20 0.38
OPRK1 P41145 5/20 0.38
MET P08581 3/20 0.37
RAF1 P04049 2/20 0.36
BRAF P15056 2/20 0.36
EGFR P00533 1/20 0.36
BRD4 O60885 1/20 0.36
AXL P30530 1/20 0.35
MERTK Q12866 1/20 0.35

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
SCHEMBL9905428 0.86 AXL (0.38) MST1RMETRAF1BRAFEGFR
SCHEMBL14691553 0.86 OPRK1 (0.42) OPRM1OPRD1OPRK1METRAF1
SCHEMBL1161307 0.85 PARP10 (0.39) METRAF1BRAFEGFRAXL
SCHEMBL1161052 0.81 MST1R (0.47) MST1RMETRAF1BRAFAXL
SCHEMBL11029672 0.81 MST1R (0.38) MST1RBRAFEGFR
SCHEMBL12873343 0.81 MST1R (0.45) MST1RMETRAF1BRAFAXL
SCHEMBL11034017 0.81 MET (0.48) MST1RMETBRD4AXLMERTK
SCHEMBL11030933 0.80 MST1R (0.51) MST1RMETBRAFAXL
SCHEMBL9905443 0.80 MST1R (0.51) MST1ROPRM1OPRD1OPRK1MET
SCHEMBL11031594 0.79 MET (0.49) MST1RMETBRAFAXL

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-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
EP-2461869-A1 NOVEL BICYCLIC UREA COMPOUNDS Merck Patent GmbH (DE) 2012-06-13 EP 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 MST1R 2790/4885OPRM1 3420/4885OPRD1 3740/4885

“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.