SCHEMBL30002763

SCHEMBL30002763

C[Si](C)(C)CCOCn1ccc2c(-n3cnc4ccccc43)nc(Cl)nc21

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 15/20 0.38
MKNK2 Q9HBH9 13/20 0.37
MAPK1 P28482 1/20 0.36
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
NPC1 O15118 1/20 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
SCHEMBL28894262 1.00 MKNK1 (0.38) MKNK1MKNK2MAPK1LMNASMN1; SMN2
SCHEMBL30002021 0.85 HRH3 (0.35) HRH3NPC1
SCHEMBL30001992 0.78 TTK (0.60) MKNK1
SCHEMBL1291499 0.77 HDAC1 (0.38) HRH3NPC1
SCHEMBL17467249 0.76 KDM4E (0.39) LMNASMN1; SMN2HRH3NPC1
SCHEMBL31497497 0.75 DGAT1 (0.37) HRH3NPC1
SCHEMBL17466924 0.74 HRH3 (0.53) SMN1; SMN2HRH3
SCHEMBL13737735 0.74 DGAT1 (0.34) HRH3NPC1
SCHEMBL17466967 0.73 EGFR (0.37) MAPK1LMNANPC1
SCHEMBL2357255 0.73 SMN1; SMN2 (0.56) LMNASMN1; SMN2NPC1

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
CN-115368364-B 7H-pyrrolo [2,3-d ] pyrimidine derivatives, preparation method and application thereof 四川大学 2024-07-16 CN disclosed
CN-115368364-A 7H-pyrrolo [2,3-d ] pyrimidine derivative and preparation method and application thereof 四川大学 2022-11-22 CN disclosed