SCHEMBL15317969

SCHEMBL15317969

COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)N(COP(=O)(O)OC(C)(C)C)C(=O)C(C)(C)O4)n2)cc(OC)c1OC

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 13/20 0.85
▸ PLK4 O00444 4/20 0.85
▸ RET P07949 4/20 0.85
▸ FLT3 P36888 4/20 0.85
▸ MAPK8 P45983 4/20 0.85
▸ MAPK9 P45984 4/20 0.85
▸ PTK2 Q05397 4/20 0.85
▸ AURKB Q96GD4 3/20 0.85
▸ AURKA O14965 3/20 0.85
▸ MST1R Q04912 3/20 0.85
▸ IKBKE Q14164 3/20 0.85
▸ STK16 O75716 2/20 0.85
▸ TNK1 Q13470 2/20 0.85
▸ MAP3K11 Q16584 2/20 0.85
▸ ADCK1 Q86TW2 2/20 0.85
▸ PIP4K2C Q8TBX8 2/20 0.85
▸ NEK9 Q8TD19 2/20 0.85
▸ IRAK3 Q9Y616 2/20 0.85
▸ LATS1 O95835 1/20 0.85
▸ BRDT Q58F21 1/20 0.85

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
SCHEMBL2627481 0.93 SYK (0.82) SYKPLK4RETFLT3MAPK8
SCHEMBL13984998 0.93 SYK (0.89) SYKPLK4RETFLT3MAPK8
Fostamatinib SCHEMBL29351337 0.92 SYK (1.00) SYKPLK4RETFLT3MAPK8
Fostamatinib SCHEMBL1201371 0.92 SYK (1.00) SYKPLK4RETFLT3MAPK8
SCHEMBL13451994 0.91 SYK (0.91) SYKPLK4RETFLT3MAPK8
Fostamatinib SCHEMBL22164570 0.91 SYK (0.99) SYKPLK4RETFLT3MAPK8
Fostamatinib SCHEMBL16820327 0.91 SYK (0.99) SYKPLK4RETFLT3MAPK8
Fostamatinib SCHEMBL28519986 0.91 SYK (0.97) SYKPLK4RETFLT3MAPK8
SCHEMBL10291092 0.91 SYK (0.78) SYKPLK4RETFLT3MAPK8
SCHEMBL16820329 0.90 SYK (0.89) SYKPLK4RETFLT3MAPK8

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
US-8691798-B2 Synthesis of 2,4-pyrimidinediamines RIGEL PHARMACEUTICALS, INC. (US) 2014-04-08 — — US disclosed
US-20130274499-A1 Synthesis of 2,4-Pyrimidinediamines MIDCAP FINANCIAL TRUST 2013-10-17 — — US 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-20130274499-A1 Synthesis of 2,4-Pyrimidinediamines DPYD, TYMS, TYMP SYK 3076/4885PLK4 1108/4885RET 2127/4885

“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.

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