SCHEMBL19297735

SCHEMBL19297735

CC1C(=O)Nc2cc(Nc3nc(Nc4ccc5cn[nH]c5c4)ncc3F)ccc2S1(=O)=O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.55
PDGFRB P09619 7/20 0.46
PDGFRA P16234 7/20 0.46
CDC7 O00311 1/20 0.44
CDK1 P06493 1/20 0.43
EGFR P00533 1/20 0.43
FGFR1 P11362 1/20 0.43
ROCK2 O75116 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
SCHEMBL19297712 0.87 AURKA (0.50) SYKCDK1EGFRFGFR1
SCHEMBL19297756 0.85 CDK1 (0.46) SYKCDK1EGFRFGFR1
SCHEMBL12389624 0.84 SYK (0.57) SYKPDGFRBPDGFRACDC7CDK1
SCHEMBL19297758 0.83 SYK (0.60) SYK
SCHEMBL19297760 0.83 EGFR (0.45) SYKEGFR
SCHEMBL12389631 0.82 SYK (0.57) SYKPDGFRBPDGFRACDC7CDK1
SCHEMBL12389643 0.82 SYK (0.58) SYKPDGFRBPDGFRACDC7CDK1
SCHEMBL19297724 0.82 SYK (0.53) SYKPDGFRBPDGFRACDC7CDK1
SCHEMBL19297730 0.82 SYK (0.43) SYKCDK1EGFRFGFR1
SCHEMBL19297745 0.81 BCL6 (0.56) SYKEGFR

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