SCHEMBL25377444

SCHEMBL25377444

CCCC[C@](C)(CNC(=O)c1cnn(C)c1)Nc1nc(NCc2ccc(OC)cc2OC)nc2cc(B(O)O)cnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.39
▸ TYRO3 Q06418 1/20 0.39
▸ MERTK Q12866 1/20 0.39
▸ GAS6 Q14393 1/20 0.39
▸ KDR P35968 2/20 0.37
▸ FGFR3 P22607 1/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ PDGFRB P09619 1/20 0.37
▸ BCDIN3D Q7Z5W3 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ TSHR P16473 3/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ LMNA P02545 3/20 0.33
▸ CYP1A2 P05177 4/20 0.33
▸ CYP3A4 P08684 4/20 0.33
▸ CYP2C19 P33261 4/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ CYP2D6 P10635 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ MAPT P10636 2/20 0.33

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
SCHEMBL31248311 0.88 KDR (0.38) FLT3TYRO3MERTKGAS6KDR
SCHEMBL29099894 0.85 FLT3 (0.39) FLT3TYRO3MERTKGAS6KDR
SCHEMBL29099891 0.85 FLT3 (0.39) FLT3TYRO3MERTKGAS6KDR
SCHEMBL25377448 0.84 KDR (0.37) FLT3TYRO3MERTKGAS6KDR
SCHEMBL25374138 0.84 TLR8 (0.45) FLT3TYRO3MERTKGAS6BCDIN3D
SCHEMBL25374136 0.84 TLR8 (0.45) FLT3TYRO3MERTKGAS6BCDIN3D
SCHEMBL30570467 0.83 FLT3 (0.39) FLT3TYRO3MERTKGAS6BCDIN3D
SCHEMBL25376815 0.83 FLT3 (0.39) FLT3TYRO3MERTKGAS6BCDIN3D
SCHEMBL25376813 0.83 FLT3 (0.39) FLT3TYRO3MERTKGAS6BCDIN3D
SCHEMBL25377704 0.83 JAK3 (0.38) FLT3TYRO3MERTKGAS6KDR

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
EP-4484426-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG Sunshine Lake Pharma Co., Ltd. (CN) 2025-01-01 — — EP disclosed
WO-2023160527-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG 广东东阳光药业股份有限公司 2023-08-31 — — WO disclosed
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