SCHEMBL190375

SCHEMBL190375

O=C1Nc2cc(Nc3nc(Nc4cccc(O)c4)ncc3F)ccc2OC1C1CC1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.70
AURKA O14965 2/20 0.51
MAPK8 P45983 1/20 0.51
AURKB Q96GD4 1/20 0.51
CDK19 Q9BWU1 1/20 0.51
JAK2 O60674 1/20 0.48
EGFR P00533 1/20 0.48
LCK P06239 1/20 0.48
LYN P07948 1/20 0.48
FGFR4 P22455 1/20 0.48

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
SCHEMBL190515 0.85 SYK (0.61) SYKJAK2EGFRLCKLYN
SCHEMBL190333 0.83 SYK (0.49) SYKAURKAMAPK8AURKBJAK2
SCHEMBL191238 0.83 SYK (0.54) SYKAURKAMAPK8AURKBJAK2
SCHEMBL189926 0.83 SYK (0.46) SYKJAK2EGFRLCKLYN
SCHEMBL656760 0.82 SYK (1.00) SYKAURKAMAPK8AURKBCDK19
SCHEMBL30009410 0.82 SYK (1.00) SYKAURKAMAPK8AURKBCDK19
SCHEMBL30009889 0.82 SYK (1.00) SYKAURKAMAPK8AURKBCDK19
SCHEMBL656578 0.82 SYK (1.00) SYKAURKAMAPK8AURKBCDK19
SCHEMBL13007743 0.81 SYK (0.72) SYKAURKAMAPK8AURKBCDK19
SCHEMBL657903 0.80 SYK (0.71) SYKAURKAMAPK8AURKBCDK19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1814878-B1 SPIRO-2, 4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2012-01-04 EP disclosed
US-7851480-B2 Spiro 2,4-pyrimidinediamine compounds and their uses RIGEL PHARMACEUTICALS, INC. (US) 2010-12-14 US disclosed
US-20090062270-A1 SPIRO 2,4 PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. 2009-03-05 US disclosed
EP-1814878-A1 SPIRO-2, 4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2007-08-08 EP disclosed
WO-2006068770-A1 SPIRO-2, 4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2006-06-29 WO 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-20090062270-A1 SPIRO 2,4 PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES SSB, SPHK2, PKD2 SYK 1168/4885AURKA 2921/4885MAPK8 2304/4885

“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.