SCHEMBL30337249

SCHEMBL30337249

Cc1cc(C(C)(C)C)c(C)c(Cc2c(C)c(C(C)(C)C)cc(C)c2O)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 5/20 0.58
SMN1; SMN2 Q16637 5/20 0.58
CYP2C9 P11712 4/20 0.58
HIF1A Q16665 4/20 0.58
TP53 P04637 2/20 0.58
CYP1A2 P05177 3/20 0.48
HSPA5 P11021 2/20 0.44
ALDH1A1 P00352 4/20 0.43
CA2 P00918 3/20 0.43
POLB P06746 1/20 0.43
TYR P14679 1/20 0.43
LMNA P02545 3/20 0.43
CYP3A4 P08684 3/20 0.43
TSHR P16473 3/20 0.43
HTR1A P08908 2/20 0.43
ADRA2A P08913 2/20 0.43
CYP2D6 P10635 2/20 0.43
PTGS2 P35354 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL833037 0.86 CYP2C19 (0.70) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL9768525 0.84 CYP2C19 (0.68) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL10814873 0.80 CYP2C19 (0.61) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL11341071 0.79 CYP2C19 (0.56) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL9331710 0.77 CYP2C19 (0.58) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL10967992 0.76 CYP2C19 (0.57) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL1476812 0.75 CYP2C19 (0.52) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL31424079 0.75 CYP2C19 (0.52) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL7083042 0.74 CYP2C19 (0.51) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53
SCHEMBL31612404 0.74 CYP2C19 (0.51) CYP2C19SMN1; SMN2CYP2C9HIF1ATP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118146890-A Laundry treatment composition comprising polyalkylene carbonate compound 宝洁公司 2024-06-07 CN disclosed
EP-4162017-A1 PARTICULATE LAUNDRY ADDITIVE The Procter & Gamble Company (US) 2023-04-12 EP disclosed
CN-115916935-A Granular laundry detergent additive 宝洁公司 2023-04-04 CN disclosed