SCHEMBL30337273

SCHEMBL30337273

CCC(C)c1cc(Cc2cc(C(C)CC)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.56
CYP2C9 P11712 6/20 0.53
CYP2C19 P33261 6/20 0.53
HIF1A Q16665 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
CYP1A2 P05177 4/20 0.53
CYP2D6 P10635 2/20 0.53
HSD17B10 Q99714 2/20 0.47
TSHR P16473 3/20 0.40
CYP3A4 P08684 2/20 0.40
CA2 P00918 3/20 0.38
CA1 P00915 2/20 0.38
ALDH1A1 P00352 4/20 0.37
POLB P06746 1/20 0.37
TYR P14679 1/20 0.37
GAA P10253 3/20 0.37
ALOX15 P16050 3/20 0.37
USP2 O75604 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL10778785 1.00 HSPA5 (0.56) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL22190072 0.90 CYP1A2 (0.53) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL144821 0.88 CA2 (0.50) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL3810036 0.84 CYP1A2 (0.71) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL30337604 0.84 CYP1A2 (0.71) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL8973273 0.83 CYP1A2 (0.47) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL2951999 0.83 CYP1A2 (0.44) HSPA5CYP2C9CYP2C19SMN1; SMN2CYP1A2
SCHEMBL12626206 0.81 CYP2C9 (0.52) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL99080 0.80 CYP2C9 (0.47) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL9777449 0.78 CYP2C9 (0.47) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2

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