SCHEMBL5774607

SCHEMBL5774607

CC/C=C\CCC(C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.46
CYP1A2 P05177 1/20 0.46
ALDH1A1 P00352 6/20 0.46
MAPT P10636 4/20 0.46
CYP19A1 P11511 4/20 0.45
PPARG P37231 3/20 0.45
OXER1 Q8TDS5 3/20 0.45
RXRA P19793 2/20 0.45
FFAR1 O14842 2/20 0.45
F7 P08709 3/20 0.42
F3 P13726 3/20 0.42
PPARA Q07869 3/20 0.42
PTGS1 P23219 2/20 0.42
KMT2A Q03164 2/20 0.42
PPARD Q03181 2/20 0.42
ADORA3 P0DMS8 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
BLM P54132 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL5586091 1.00 GABRR1 (0.46) GABRR1CYP1A2ALDH1A1MAPTCYP19A1
SCHEMBL5586095 1.00 GABRR1 (0.46) GABRR1CYP1A2ALDH1A1MAPTCYP19A1
SCHEMBL469265 0.94 ALDH1A1 (0.55) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL14767921 0.94 ALDH1A1 (0.55) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL14767922 0.94 ALDH1A1 (0.55) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL5407249 0.91 GABRR1 (0.54) GABRR1CYP1A2ACE2BLM
SCHEMBL5407252 0.91 GABRR1 (0.54) GABRR1CYP1A2ACE2BLM
SCHEMBL892782 0.89 ALDH1A1 (0.57) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL892781 0.89 ALDH1A1 (0.57) ALDH1A1MAPTCYP19A1PPARGOXER1
SCHEMBL5934152 0.88 ALDH1A1 (0.48) GABRR1CYP1A2ALDH1A1MAPTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2020225-B1 Fragrance composition KAO CORP (JP) 2014-10-08 EP claimed
EP-2226063-B1 High intensity fragrances TAKASAGO PERFUMERY CO LTD (JP) 2013-04-10 EP claimed
EP-1708570-A2 COMPOSITION AND USE THEREOF AS ATTRACTANT FOR THE GARDEN CHAFER i (PHYLLOPERTHA HORTICOLA) /i Freie Universität Berlin (DE) 2006-10-11 EP claimed
WO-2005072526-A2 COMPOSITION AND USE THEREOF AS ATTRACTANT FOR THE GARDEN CHAFER (PHYLLOPERTHA HORTICOLA) FREIE UNIVERSITÄT BERLIN (DE) 2005-08-11 WO claimed
CN-116568613-A Individual package for underpants type absorbent article and package for individual package for underpants type absorbent article 尤妮佳股份有限公司 2023-08-08 CN disclosed
CN-216823898-U Absorbent article 尤妮佳股份有限公司 2022-06-28 CN disclosed
CN-111387187-A Bemisia tabaci attractant composition and application thereof 中国农业科学院植物保护研究所 2020-07-10 CN disclosed
EP-1708570-A2 COMPOSITION AND USE THEREOF AS ATTRACTANT FOR THE GARDEN CHAFER i (PHYLLOPERTHA HORTICOLA) /i Freie Universität Berlin (DE) 2006-10-11 EP disclosed
WO-2005072526-A2 COMPOSITION AND USE THEREOF AS ATTRACTANT FOR THE GARDEN CHAFER (PHYLLOPERTHA HORTICOLA) FREIE UNIVERSITÄT BERLIN (DE) 2005-08-11 WO disclosed