SCHEMBL30898482

SCHEMBL30898482

Cc1cc(C)c(O)c(Cc2cc(Cl)cc(Cc3cc(C)cc(C)c3O)c2O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 5/20 0.52
CYP2C19 P33261 5/20 0.52
HIF1A Q16665 4/20 0.52
AMY1A P0DUB6 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
HSPA5 P11021 2/20 0.47
HSD17B10 Q99714 4/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
CYP2D6 P10635 3/20 0.45
HSP90AA1 P07900 2/20 0.43
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
SHBG P04278 1/20 0.40
CYP3A4 P08684 3/20 0.39
MEN1 O00255 1/20 0.39
SLC22A1 O15245 1/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL12786466 1.00 CYP2C9 (0.52) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL30374837 0.90 AMY1A (0.61) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL15105759 0.90 AMY1A (0.61) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL30669854 0.90 AMY1A (0.61) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL4456468 0.90 AMY1A (0.61) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL67802 0.88 CYP2C9 (0.53) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL69707 0.88 AMY1A (0.57) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL8733376 0.82 SHBG (0.60) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL17278917 0.81 AMY1A (0.52) CYP2C9CYP2C19HIF1AAMY1ASMN1; SMN2
SCHEMBL19421993 0.79 AMY1A (0.50) CYP2C9CYP2C19HIF1AAMY1ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4633804-A1 PROCESS FOR PREPARING ALPHA,BETA-UNSATURATED CARBONYL COMPOUND Firmenich SA (CH) 2025-10-22 EP disclosed
WO-2024126769-A1 PROCESS FOR PREPARING ALPHA,BETA-UNSATURATED CARBONYL COMPOUND FIRMENICH SA (CH) 2024-06-20 WO disclosed