SCHEMBL7707664

SCHEMBL7707664

Cn1nc(-c2ccc(Cl)c(I)c2)c(Cl)c1OC(F)F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 7/20 0.35
GRIN2B Q13224 3/20 0.34
SLC34A1 Q06495 1/20 0.32
GRIN1 Q05586 1/20 0.30
GRM2 Q14416 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
SCHEMBL7781838 0.86 KCNH2 (0.38) KCNH2GRIN2BSLC34A1GRIN1GRM2
SCHEMBL7713559 0.85 SCN9A (0.36) KCNH2GRIN2BSLC34A1GRIN1GRM2
SCHEMBL7713566 0.82 KCNH2 (0.34) KCNH2GRIN2BSLC34A1GRIN1
SCHEMBL7707659 0.81 KCNH2 (0.36) KCNH2GRIN2BSLC34A1GRIN1
SCHEMBL7711790 0.81 KCNH2 (0.34) KCNH2GRIN2BSLC34A1GRIN1
SCHEMBL7713512 0.81 HPGD (0.40) KCNH2GRIN2BGRIN1GRM2
SCHEMBL7707669 0.81 KCNH2 (0.34) KCNH2GRIN2BSLC34A1
SCHEMBL7707584 0.81 KDM4E (0.38)
Hydrochloric Acid SCHEMBL7711752 0.81 KCNH2 (0.35) KCNH2GRIN2BSLC34A1
SCHEMBL7711793 0.81 TRPV4 (0.35) KCNH2GRIN2BSLC34A1GRM2

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
US-6365552-B1 AS HERBICIDE BASF AKTIENGESELLSCHAFT (DE) 2002-04-02 US disclosed
US-5928999-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1999-07-27 US disclosed