SCHEMBL31058445

SCHEMBL31058445

C=C1C=C[C@](C)(CCOC(C)=O)[C@@H]1C

nearest known ligand 0.31

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.31
PGR P06401 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
HTR1A P08908 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRM3 P20309 1/20 0.30
TBXA2R P21731 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA7 P36544 1/20 0.30
CHRNA4 P43681 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CHRNA10 Q9GZZ6 1/20 0.30
CHRNA9 Q9UGM1 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL31058441 1.00 ALDH1A1 (0.31) ALDH1A1PGRCHRM2CHRM4HTR1A
SCHEMBL31058440 1.00 ALDH1A1 (0.31) ALDH1A1PGRCHRM2CHRM4HTR1A
SCHEMBL31058437 1.00 ALDH1A1 (0.31) ALDH1A1PGRCHRM2CHRM4HTR1A
SCHEMBL31058443 1.00 ALDH1A1 (0.31) ALDH1A1PGRCHRM2CHRM4HTR1A
SCHEMBL31058444 0.85 ALDH1A1 (0.34) ALDH1A1
SCHEMBL31058446 0.85 ALDH1A1 (0.34) ALDH1A1
SCHEMBL31058439 0.85 ALDH1A1 (0.34) ALDH1A1
SCHEMBL31058438 0.85 ALDH1A1 (0.34) ALDH1A1
SCHEMBL31058442 0.85 ALDH1A1 (0.34) ALDH1A1
SCHEMBL20159531 0.69 ALDH1A1 (0.32) ALDH1A1PGRCHRM2CHRM4HTR1A

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-4414358-B9 COMPOUNDS AND COMPOSITIONS THAT ATTRACT THE SPECIES PSEUDOCOCCUS LONGISPINUS, ATTRACTANT DEVICE AND METHODS FOR CONTROLLING AND/OR MONITORING THE PEST UNIV VALENCIA POLITECNICA (ES) 2026-03-11 EP disclosed
EP-4414358-B1 COMPOUNDS AND COMPOSITIONS THAT ATTRACT THE SPECIES PSEUDOCOCCUS LONGISPINUS, ATTRACTANT DEVICE AND METHODS FOR CONTROLLING AND/OR MONITORING THE PEST UNIV VALENCIA POLITECNICA (ES) 2025-11-12 EP disclosed
EP-4414358-A1 COMPOUNDS AND COMPOSITIONS THAT ATTRACT THE SPECIES PSEUDOCOCCUS LONGISPINUS, ATTRACTANT DEVICE AND METHODS FOR CONTROLLING AND/OR MONITORING THE PEST Universitat Politècnica de València (ES) 2024-08-14 EP disclosed