SCHEMBL28810667

SCHEMBL28810667

CC1CCCCC(n2ccc(F)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ ABCB1 P08183 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL28810398 0.86 ABCB1 (0.35) ABCB1HTT
SCHEMBL28811470 0.81 LMNA (0.38) LMNATP53NPSR1
SCHEMBL28810635 0.73 PKM (0.35) LMNATP53NPSR1
SCHEMBL28811463 0.71 — —
SCHEMBL28811466 0.70 ABCB1 (0.33) LMNATP53NPSR1ABCB1
SCHEMBL28810402 0.67 ALDH1A1 (0.33) LMNAKDM4E
SCHEMBL19626479 0.67 ALDH1A1 (0.33) LMNAKDM4E
SCHEMBL28810749 0.65 CDK5 (0.33) LMNAKDM4E
SCHEMBL28809769 0.63 MEN1 (0.36) LMNANPSR1HTT
SCHEMBL28810606 0.63 SLC18A3 (0.32) HTT

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
CN-114746090-A Azaindole carboxamide compounds for the treatment of mycobacterial infections 结核病药物开发全球联盟公司 2022-07-12 — — CN disclosed
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