SCHEMBL17005779

SCHEMBL17005779

NC(=O)c1cnc(Nc2ccc3c(c2)CNCC3)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.55
CAMK2D Q13557 1/20 0.50
MELK Q14680 1/20 0.49
PTK2 Q05397 1/20 0.48
BTK Q06187 2/20 0.46
ROCK2 O75116 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKG1 Q13976 1/20 0.46
PKN2 Q16513 1/20 0.46
IGF1R P08069 1/20 0.46
BPTF Q12830 1/20 0.46
SLC2A1 P11166 1/20 0.46
AXL P30530 1/20 0.46
TYRO3 Q06418 1/20 0.46
MERTK Q12866 1/20 0.46
WEE1 P30291 3/20 0.45
F2 P00734 1/20 0.45
PLG P00747 1/20 0.45
PLAU P00749 1/20 0.45
PLAT P00750 1/20 0.45

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
SCHEMBL15621933 0.78 MELK (0.65) MELKROCK2PRKCEPRKG1PKN2
SCHEMBL17005759 0.77 SYK (0.55) SYKPTK2BTKROCK2AXL
SCHEMBL1033504 0.75 PNMT (0.53) MELK
SCHEMBL29728413 0.75 PNMT (0.53) MELK
SCHEMBL8117385 0.74 MELK (0.63) MELKROCK2PRKCEPRKG1PKN2
Hydrochloric Acid SCHEMBL17748278 0.74 PNMT (0.51) MELKSLC2A1
SCHEMBL29729704 0.73 TYRO3 (0.53) BTKIGF1RAXLTYRO3MERTK
SCHEMBL3689547 0.71 HRH3 (0.60)
SCHEMBL17005748 0.71 SYK (0.61) SYK
SCHEMBL28917049 0.71 IGF1R (0.67) BTKIGF1RAXLTYRO3MERTK

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-9533989-B2 Substituted pyrimidine-5-carboxamides as spleen tyrosine kinase inhibitors Ziarco Pharma Ltd. (GB) 2017-01-03 US disclosed
US-20150232470-A1 2-(-Aminocyclohexyl)Amino-Pyrimidine-5-Carboxamides as Spleen Tyrosine Kinasei(SYK) Inhibitors PFIZER LIMITED (GB) 2015-08-20 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-20150232470-A1 2-(-Aminocyclohexyl)Amino-Pyrimidine-5-Carboxamides as Spleen Tyrosine Kinasei(SYK) Inhibitors SYK, BTK, LCK SYK 1/4885CAMK2D 1089/4885MELK 1733/4885

“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.