SCHEMBL30749429

SCHEMBL30749429

CCCCCCCC(CC)c1ncc2ccncc2n1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 1/20 0.35
▸ LATS1 O95835 7/20 0.33
▸ LATS2 Q9NRM7 6/20 0.33
▸ PDE5A O76074 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HASPIN Q8TF76 1/20 0.31

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
Hydrochloric Acid SCHEMBL30749395 0.99 PDE5A (0.35) NR1I2LATS1LATS2PDE5AFAAH
SCHEMBL38660096 0.85 GPR84 (0.34) LATS1LATS2PDE5AFAAHTDP1
SCHEMBL30402892 0.83 TLR8 (0.41) NR1I2SMN1; SMN2
SCHEMBL30543203 0.83 TLR8 (0.41) NR1I2SMN1; SMN2
SCHEMBL30749411 0.82 NR1I2 (0.36) NR1I2LATS1LATS2FAAHTDP1
SCHEMBL30746985 0.82 GPBAR1 (0.41) NR1I2L3MBTL1KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL30543224 0.81 GPBAR1 (0.40) NR1I2SMN1; SMN2
Hydrochloric Acid SCHEMBL11061109 0.80 PDE5A (0.35) NR1I2LATS1LATS2PDE5AFAAH
SCHEMBL8218133 0.77 TLR8 (0.38) L3MBTL1KDM4ESMN1; SMN2
SCHEMBL30749402 0.76 NR1I2 (0.32) NR1I2

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-117425654-A 2, 8-diazaspiro [4.5] decane compounds 基因泰克公司 2024-01-19 — — CN disclosed
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