SCHEMBL30714939

SCHEMBL30714939

OCc1cc2c(cc1Cl)OC(F)(F)O2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
STIM1 Q13586 2/20 0.36
ORAI1 Q96D31 2/20 0.36
CTNNB1 P35222 2/20 0.34
WNT3A P56704 2/20 0.34
ALPL P05186 1/20 0.33
GPR3 P46089 1/20 0.31
FLT1 P17948 1/20 0.30
AHR P35869 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
SCHEMBL30714928 0.82 ALPL (0.34) STIM1ORAI1CTNNB1WNT3AALPL
SCHEMBL30310962 0.81 CTNNB1 (0.34) CTNNB1WNT3AGPR3
SCHEMBL29010825 0.81 CTNNB1 (0.34) CTNNB1WNT3AGPR3
SCHEMBL31410945 0.81 TSHR (0.48) ALPLFLT1AHR
SCHEMBL30714927 0.80 STIM1 (0.39) STIM1ORAI1CTNNB1WNT3AALPL
SCHEMBL26696489 0.80 CYP1A2 (0.30)
SCHEMBL8759431 0.79 ALPL (0.48) STIM1ORAI1CTNNB1WNT3AALPL
SCHEMBL30714934 0.78
Hydrochloric Acid SCHEMBL20563200 0.77 TAAR1 (0.36) STIM1ORAI1ALPL
SCHEMBL2383983 0.74 CRHBP (0.43)

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
CN-119403791-A Isoxazolidine derivatives as herbicidal compounds 先正达农作物保护股份公司 2025-02-07 CN disclosed
WO-2023247293-A1 ISOXALIDINE DERIVATIVES AS HERICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-12-28 WO disclosed