SCHEMBL19297754

SCHEMBL19297754

COc1ccc(Nc2ncc(F)c(Nc3ccc4c(c3)NC(=O)CS4)n2)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 12/20 0.58
NCOR2 Q9Y618 2/20 0.55
SYK P43405 4/20 0.53
EGFR P00533 1/20 0.47
STK17B O94768 1/20 0.47
STK17A Q9UEE5 1/20 0.47
PTK2 Q05397 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
SCHEMBL19297718 0.92 SYK (0.48) BCL6SYKEGFRPTK2
SCHEMBL19297725 0.90 SYK (0.56) BCL6SYKEGFRSTK17BSTK17A
SCHEMBL19297722 0.88 SYK (0.57) SYKEGFR
SCHEMBL19297748 0.86 BCL6 (0.58) BCL6NCOR2SYKEGFRSTK17B
SCHEMBL1382932 0.86 SYK (0.53) SYKEGFRSTK17BSTK17APTK2
SCHEMBL19297749 0.85 AURKA (0.52) SYKEGFR
SCHEMBL14607335 0.83 SYK (0.67) BCL6NCOR2SYK
SCHEMBL19297723 0.83 BCL6 (0.59) BCL6NCOR2SYKEGFRSTK17B
SCHEMBL655635 0.83 BCL6 (0.80) BCL6NCOR2SYKEGFRSTK17B
SCHEMBL3183762 0.82 KIF11 (0.45) BCL6NCOR2SYK

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
US-9751893-B2 Methods of treating or preventing autoimmune diseases with 2,4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS, INC. (US) 2017-09-05 US claimed