SCHEMBL24648552

SCHEMBL24648552

COC(=O)Cn1ncc2cc(O[Si](C)(C)C(C)(C)C)ccc21

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.43
CA12 O43570 4/20 0.41
CA1 P00915 4/20 0.41
CA9 Q16790 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PLA2G4A P47712 1/20 0.37
TP53 P04637 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL30084990 0.88 KMO (0.49) CA12CA1CA9NPC1RAB9A
SCHEMBL15447289 0.79 SYK (0.48) SYKNPC1RAB9AKDM4EHSD17B10
SCHEMBL19023119 0.77 SYK (0.56) SYKNPC1RAB9APOLBKDM4E
SCHEMBL14564354 0.77 SYK (0.48) SYKNPC1RAB9APOLBKDM4E
SCHEMBL655559 0.76 CHEK1 (0.54) SYKNPC1RAB9AKDM4EHSD17B10
SCHEMBL4300707 0.76 NPC1 (0.56) NPC1RAB9APOLBKDM4EHSD17B10
SCHEMBL23860118 0.74 CA12 (0.41) CA12CA1CA9NPC1RAB9A
SCHEMBL18344998 0.74 CA12 (0.43) CA12CA1CA9RAB9A
SCHEMBL23631639 0.74 KMO (0.59) SYKNPC1RAB9AKDM4EHSD17B10
SCHEMBL24648604 0.73 NPC1 (0.47) NPC1RAB9APOLB

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
WO-2022221960-A1 COMPOUNDS FOR TREATING PROLIFERATOR-ACTIVATED RECEPTORS (PPAR) MEDIATED DISEASES OR CONDITIONS Medipure Pharmaceuticals Inc. (CA) 2022-10-27 WO disclosed