SCHEMBL8967739

SCHEMBL8967739

CC(C=CC1C(F)C1c1ccc(Cl)c(Cl)c1)=CC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
SLC6A2 P23975 7/20 0.33
SLC6A4 P31645 7/20 0.33
SLC6A3 Q01959 5/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.30
MAOB P27338 2/20 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
SCHEMBL8967700 0.89 SLC6A4 (0.37) SLC6A2SLC6A4SLC6A3
SCHEMBL9580479 0.82 PYGL (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL9580493 0.80 HPGD (0.41) SLC6A2SLC6A4SLC6A3SMN1; SMN2TSHR
SCHEMBL9255677 0.74 SLC6A4 (0.39) NPSR1SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL9258443 0.74 RXRA (0.36) MEN1KMT2A
SCHEMBL9452367 0.74 SLC6A4 (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL8967144 0.74
SCHEMBL8967736 0.71 NPSR1 (0.38) NPSR1SLC6A2SLC6A4SLC6A3
SCHEMBL9400348 0.71 NPSR1 (0.38) NPSR1SLC6A2SLC6A4SLC6A3
SCHEMBL8967135 0.71

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
EP-0553081-B1 PESTICIDES ROUSSEL UCLAF (FR) 1996-02-28 EP disclosed
US-5326755-A Contain cyclopropane ring ROUSSEL UCLAF 1994-07-05 US disclosed