SCHEMBL20155274

SCHEMBL20155274

Cc1cc(Nc2ncc(-c3cccs3)c(NC3CCNCC3)n2)n[nH]1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 4/20 0.52
PAK4 O96013 3/20 0.52
TYRO3 Q06418 9/20 0.45
SELP P16109 1/20 0.45
MERTK Q12866 7/20 0.45
AXL P30530 6/20 0.44
IGF1R P08069 3/20 0.43
CTSC P53634 1/20 0.42
CHEK1 O14757 1/20 0.41
FLT3 P36888 2/20 0.41
GAS6 Q14393 2/20 0.41
SYK P43405 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
SCHEMBL20154970 0.85 AXL (0.52) PAK4TYRO3SELPMERTKAXL
SCHEMBL20154904 0.81 PLK4 (0.52) PLK4PAK4TYRO3SELPMERTK
SCHEMBL20155307 0.79 TYRO3 (0.63) PLK4PAK4TYRO3MERTKAXL
SCHEMBL21299961 0.73 PLK4 (0.50) PLK4PAK4TYRO3SELPMERTK
SCHEMBL30373488 0.72 PAK4 (0.67) PLK4PAK4IGF1R
SCHEMBL30373439 0.72 PAK4 (0.61) PLK4PAK4TYRO3IGF1RSYK
SCHEMBL20154911 0.67 TYRO3 (0.54) PAK4TYRO3SELPMERTKAXL
SCHEMBL23889462 0.65 PAK4 (0.66) PLK4PAK4
SCHEMBL13022269 0.65 CDK1 (0.52) SYK
SCHEMBL17999849 0.65 NTRK1 (0.46) PLK4PAK4IGF1RCTSCFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3530656-B1 2-SUBSTITUTED AROMATIC RING-PYRIMIDINE DERIVATIVE, AND PREPARATION AND APPLICATION THEREOF UNIV ZHEJIANG (CN) 2022-01-05 EP disclosed
US-10822327-B2 2-substituted aromatic ring-pyrimidine derivative and preparation and application thereof ZHEJIANG UNIVERSITY (CN) 2020-11-03 US disclosed
EP-3530656-A1 2-SUBSTITUTED AROMATIC RING-PYRIMIDINE DERIVATIVE, AND PREPARATION AND APPLICATION THEREOF Zhejiang University (CN) 2019-08-28 EP disclosed
WO-2018086547-A1 2-SUBSTITUTED AROMATIC RING-PYRIMIDINE DERIVATIVE, AND PREPARATION AND APPLICATION THEREOF 浙江大学 2018-05-17 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-10822327-B2 2-substituted aromatic ring-pyrimidine derivative and preparation and application thereof CHEK1, CHEK2, PLK1 PLK4 34/4885PAK4 131/4885TYRO3 719/4885

“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.