SCHEMBL27349014

SCHEMBL27349014

Cc1ncsc1-c1nc(C(F)(F)F)cn1Cc1ncc(Cl)cn1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.34
DGAT1 O75907 1/20 0.32
RXRA P19793 2/20 0.31
GRIN1 Q05586 2/20 0.31
GRIN2B Q13224 2/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 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
SCHEMBL27349028 0.89 DGAT1 (0.31) DGAT1
SCHEMBL27349031 0.80 DGAT1 (0.33) DGAT1
SCHEMBL27348126 0.79 DGAT1 (0.34) DGAT1RXRAGRIN1GRIN2BPTGS1
SCHEMBL27349024 0.79 DGAT1 (0.35) DGAT1PTGS1PTGS2
SCHEMBL27349019 0.76 DGAT1 (0.34) DGAT1RXRAGRIN1GRIN2BPTGS1
SCHEMBL27348909 0.76 PTGS2 (0.34) DGAT1PTGS2
SCHEMBL27348054 0.76 PTGS2 (0.33) DGAT1GRIN2BPTGS1PTGS2
SCHEMBL26090152 0.76 KDM4E (0.46) DGAT1RXRAGRIN1GRIN2BPTGS1
SCHEMBL26093218 0.76 PTGS2 (0.40) DGAT1PTGS1PTGS2
SCHEMBL26091849 0.74 SMN1; SMN2 (0.30) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023247358-A1 HERBICIDAL IMIDAZOLE-CONTAINING COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-12-28 WO disclosed