SCHEMBL26032126

SCHEMBL26032126

Cc1cccc(/C=N/Nc2nccc(N3CCOC(c4cccc(/C=N/Nc5ncc(F)c(N6CCOCC6)n5)c4)C3)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.53
▸ PIKFYVE Q9Y2I7 11/20 0.48
▸ KDM5A P29375 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ LMNA P02545 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ FES P07332 1/20 0.41
▸ FER P16591 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ FRK P42685 1/20 0.41
▸ SYK P43405 1/20 0.41
▸ CAMK1D Q8IU85 1/20 0.41
▸ IRAK4 Q9NWZ3 1/20 0.41
▸ NPC1 O15118 1/20 0.38

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
SCHEMBL13548872 0.84 GAA (0.70) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL13548878 0.80 LMNA (0.65) GAAPIKFYVEKDM4EMAPTLMNA
SCHEMBL26032125 0.79 KDM5A (0.49) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL20363504 0.74 GAA (0.62) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL4411464 0.74 GAA (0.72) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL13548879 0.74 KDM5A (0.74) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL4407764 0.73 PIKFYVE (0.61) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL18827489 0.72 GAA (0.72) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL14149070 0.70 KDM5A (0.55) GAAPIKFYVEKDM5AKDM4EMAPT
SCHEMBL21135301 0.70 PIKFYVE (0.69) GAAPIKFYVEKDM4EMAPTLMNA

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
US-11714080-B2 Compounds and methods of identifying, synthesizing, optimizing and profiling protein modulators HMI Medical Innovations, LLC (US) 2023-08-01 — — US disclosed
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