SCHEMBL22561868

SCHEMBL22561868

Cc1cc(C(=O)Nc2ccc(C)c(-c3cnc(N4CCNCC4)c(C#N)c3)c2)ccn1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 16/20 0.51
BRAF P15056 15/20 0.51
ABL1 P00519 1/20 0.47
MAPK14 Q16539 3/20 0.44
LCK P06239 1/20 0.44
CSF1R P07333 1/20 0.44
MAP2K1 Q02750 1/20 0.44

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
SCHEMBL19328136 0.90 RAF1 (0.57) RAF1BRAF
SCHEMBL19328040 0.90 RAF1 (0.59) RAF1BRAF
SCHEMBL19327962 0.90 RAF1 (0.58) RAF1BRAF
SCHEMBL19328074 0.90 RAF1 (0.55) RAF1BRAFMAPK14LCKCSF1R
SCHEMBL19328082 0.90 RAF1 (0.65) RAF1BRAF
SCHEMBL19327912 0.90 RAF1 (0.57) RAF1BRAF
SCHEMBL19328109 0.89 RAF1 (0.58) RAF1BRAF
SCHEMBL19328035 0.89 RAF1 (0.61) RAF1BRAF
SCHEMBL19328006 0.88 RAF1 (0.58) RAF1BRAF
SCHEMBL22561962 0.86 RAF1 (0.52) RAF1BRAFABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3191467-B1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS NOVARTIS AG (CH) 2020-10-21 EP disclosed