SCHEMBL6937644

SCHEMBL6937644

CC(C)(C)c1cc(C=C(O)C(=O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 2/20 0.60
GABBR1 Q9UBS5 2/20 0.60
SMN1; SMN2 Q16637 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.54
CYP3A4 P08684 3/20 0.54
MAPT P10636 3/20 0.54
TSHR P16473 3/20 0.54
BLM P54132 3/20 0.54
KMT2A Q03164 3/20 0.54
HSD17B10 Q99714 3/20 0.54
CYP1A2 P05177 3/20 0.54
CYP2C9 P11712 3/20 0.54
RGS12 O14924 2/20 0.54
GMNN O75496 2/20 0.54
LMNA P02545 2/20 0.54
TP53 P04637 2/20 0.54
HPGD P15428 2/20 0.54
ALOX15 P16050 2/20 0.54
NFKB1 P19838 2/20 0.54

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
SCHEMBL28419449 0.86 EGFR (0.63) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL7824832 0.85 GABBR2 (0.60) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL11303376 0.84 GABBR2 (0.58) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL11303373 0.84 GABBR2 (0.58) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL8579230 0.82 GABBR2 (0.57) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL8579232 0.82 GABBR2 (0.57) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL9684949 0.81 GABBR2 (0.55) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL9580152 0.81 GABBR2 (0.55) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL10799598 0.80 GABBR2 (0.48) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1
SCHEMBL10494818 0.80 GABBR2 (0.54) GABBR2GABBR1SMN1; SMN2ALDH1A1MEN1

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
EP-0818526-B1 Stabilizers for the prevention of gum formation in gasoline CIBA SC HOLDING AG (CH) 2003-02-12 EP claimed
WO-2026101210-A1 SEED BALL ADDITIVE, SEED BALL COMPOSITION COMPRISING SAME, AND MANUFACTURING METHOD THEREFOR 롯데정밀화학 주식회사 2026-05-15 WO disclosed
US-RE32334-E Molding resins E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-01-20 US disclosed