SCHEMBL30296702

SCHEMBL30296702

COC(=O)c1cc2nc(Cl)c(F)cc2n1COCC[Si](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.36
ALDH1A1 P00352 4/20 0.36
TSHR P16473 2/20 0.36
THRB P10828 1/20 0.35
NPC1 O15118 2/20 0.35
F11 P03951 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34
ALOX12 P18054 1/20 0.34
RAB9A P51151 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KMT2A Q03164 1/20 0.34
TP53 P04637 2/20 0.33
DGAT1 O75907 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
SCHEMBL26620077 1.00 MAPT (0.36) MAPTALDH1A1TSHRTHRBNPC1
SCHEMBL30983230 0.88 MAPT (0.36) MAPTALDH1A1THRBNPC1F11
SCHEMBL17548097 0.82 DGAT1 (0.34) MAPTNPC1SMN1; SMN2KDM4ERAB9A
SCHEMBL26620126 0.80 NPC1 (0.33) MAPTNPC1DGAT1
SCHEMBL30296721 0.80 NPC1 (0.33) MAPTNPC1DGAT1
SCHEMBL30296875 0.79 NPC1 (0.32) MAPTNPC1DGAT1
SCHEMBL26620672 0.79 NPC1 (0.32) MAPTNPC1DGAT1
SCHEMBL30296488 0.79 CYP11B2 (0.33) NPC1DGAT1
SCHEMBL26620205 0.79 CYP11B2 (0.33) NPC1DGAT1
SCHEMBL17391654 0.78 F11 (0.44) MAPTTHRBNPC1F11SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4402143-A1 SPIROCYCLIC COMPOUNDS Astrazeneca AB (SE) 2024-07-24 EP disclosed
CN-117916241-A Spiro compounds 阿斯利康(瑞典)有限公司 2024-04-19 CN disclosed
WO-2023036974-A1 SPIROCYCLIC COMPOUNDS ASTRAZENECA AB (SE) 2023-03-16 WO disclosed