SCHEMBL20144388

SCHEMBL20144388

Cc1cn(-c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2C(F)(F)F)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.50
LDLR P01130 1/20 0.49
KIT P10721 1/20 0.49
PCSK9 Q8NBP7 1/20 0.49
NR2E1 Q9Y466 2/20 0.49
CSF1R P07333 1/20 0.48
EPHB2 P29323 1/20 0.48
ABL1 P00519 4/20 0.47
BCR P11274 4/20 0.47
MLLT1 Q03111 1/20 0.47
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL15442439 0.91 KIT (0.54) BRAFLDLRKITPCSK9NR2E1
SCHEMBL19891274 0.88 KIT (0.56) BRAFLDLRKITPCSK9NR2E1
SCHEMBL15442426 0.85 MAPT (0.47) BRAFLDLRKITPCSK9NR2E1
SCHEMBL29958875 0.83 PSEN1 (0.52) NR2E1CSF1RPSEN1PSEN2APH1B
SCHEMBL2679904 0.81 BRAF (0.49) BRAFKITCSF1REPHB2ABL1
SCHEMBL10077762 0.81 BRAF (0.49) BRAFKITCSF1REPHB2ABL1
SCHEMBL13659898 0.79 NR2E1 (0.77) LDLRKITPCSK9NR2E1EPHB2
SCHEMBL2679720 0.79 ABL1 (0.50) BRAFLDLRKITPCSK9CSF1R
SCHEMBL10077754 0.79 ABL1 (0.50) BRAFLDLRKITPCSK9CSF1R
SCHEMBL15442334 0.79 ABL1 (0.54) KITCSF1RABL1BCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3186247-B1 PROTEIN KINASE INHIBITORS ASTAR BIOTECH LLC (US) 2021-03-03 EP disclosed
EP-2880038-B1 PROTEIN KINASE INHIBITORS ASTAR BIOTECH LLC (US) 2018-05-16 EP disclosed