Sugi Predict

Sugi Predict / Compounds / SCHEMBL30818337

SCHEMBL30818337

SCHEMBL30818337

CCCCCCCC(CC#N)CCC

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.46
▸ TSHR P16473 2/20 0.42
▸ DNM1 Q05193 2/20 0.36
▸ THRB P10828 1/20 0.35
▸ OPRM1 P35372 1/20 0.34
▸ GPR84 Q9NQS5 3/20 0.33
▸ FDPS P14324 3/20 0.33
▸ SPHK1 Q9NYA1 1/20 0.33
▸ FFAR1 O14842 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
SCHEMBL14515882 0.96 LMNA (0.50) LMNATSHRDNM1THRBOPRM1
SCHEMBL19135584 0.96 LMNA (0.50) LMNATSHRDNM1THRBOPRM1
SCHEMBL28930080 0.96 LMNA (0.50) LMNATSHRDNM1THRBOPRM1
SCHEMBL10460696 0.96 LMNA (0.50) LMNATSHRDNM1THRBOPRM1
SCHEMBL28191745 0.96 LMNA (0.50) LMNATSHRDNM1THRBOPRM1
SCHEMBL25121223 0.96 LMNA (0.50) LMNATSHRDNM1THRBOPRM1
SCHEMBL31065657 0.93 LMNA (0.48) LMNATSHRDNM1THRBOPRM1
SCHEMBL366646 0.93 TSHR (0.48) LMNATSHRDNM1THRBOPRM1
SCHEMBL6718168 0.91 TSHR (0.46) LMNATSHRDNM1
SCHEMBL764936 0.91 TSHR (0.46) LMNATSHRDNM1THRBOPRM1

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-117751126-A Oxaspiro derivative, preparation method and application thereof 上海枢境生物科技有限公司 2024-03-22 — — CN disclosed