SCHEMBL29015759

SCHEMBL29015759

CCCCOB(OCCCC)Oc1cc(C(C)(C)C)c(C)c(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.34
XBP1 P17861 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL717885 0.78 CYP3A4 (0.39)
SCHEMBL9364029 0.75 CYP3A4 (0.39)
SCHEMBL7638231 0.73 ALDH1A1 (0.35) GAAL3MBTL1
SCHEMBL8022872 0.69 LTA4H (0.53) L3MBTL1
SCHEMBL10990333 0.65 CA2 (0.55) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL50476 0.64 ADRB2 (0.45) ATM
SCHEMBL20224725 0.64 ADRB2 (0.45) ATM
SCHEMBL8727179 0.64 ADRB2 (0.45) ATM
SCHEMBL245354 0.64 ADRB2 (0.45) ATM
SCHEMBL20328579 0.64 NR5A1 (0.49)

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-108341951-B Dynamic polymer with hybrid cross-linked structure and application thereof 厦门天策材料科技有限公司 2023-06-20 CN disclosed