SCHEMBL29622847

SCHEMBL29622847

Cn1cc(Nc2nccc(NCc3cccc(C(F)(F)F)c3)n2)cn1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 4/20 0.53
AURKA O14965 7/20 0.53
IGF1R P08069 1/20 0.52
DDR2 Q16832 2/20 0.51
AXL P30530 2/20 0.50
TYRO3 Q06418 2/20 0.50
MERTK Q12866 2/20 0.50
GALR2 O43603 1/20 0.49
JAK1 P23458 2/20 0.46
JAK2 O60674 1/20 0.46
TTK P33981 1/20 0.46
SLC2A1 P11166 1/20 0.45
LRRK2 Q5S007 1/20 0.44
PLK4 O00444 1/20 0.44

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
SCHEMBL16812342 0.80 JAK3 (0.62) JAK3JAK1JAK2
SCHEMBL30455447 0.79 JAK3 (0.83) JAK3JAK1JAK2
SCHEMBL22261158 0.79 JAK3 (0.83) JAK3JAK1JAK2
SCHEMBL16812340 0.77 JAK2 (0.51) JAK3JAK1JAK2LRRK2
SCHEMBL15547156 0.77 JAK3 (0.55) JAK3JAK1JAK2
SCHEMBL29622803 0.76 JAK3 (0.51) JAK3JAK1JAK2LRRK2PLK4
SCHEMBL29622793 0.76 AURKB (0.48) JAK3JAK1JAK2LRRK2
SCHEMBL15546989 0.76 JAK3 (0.55) JAK3JAK1JAK2TTK
SCHEMBL15534846 0.76 JAK1 (0.52) JAK3JAK1JAK2LRRK2
SCHEMBL1662547 0.75 IGF1R (0.53) JAK3IGF1RDDR2AXLTYRO3

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-11344549-B2 2-substituted pyrazole amino-4-substituted amino-5-pyrimidine formamide compound, composition, and application thereof BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2022-05-31 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-11344549-B2 2-substituted pyrazole amino-4-substituted amino-5-pyrimidine formamide compound, composition, and application thereof JAK1, JAK3, JAK2 JAK3 2/4885AURKA 187/4885IGF1R 3869/4885

“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.