SCHEMBL8088839

SCHEMBL8088839

N#CCCCc1cccc(F)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
TAAR1 Q96RJ0 3/20 0.53
SLC6A4 P31645 2/20 0.50
SLC6A3 Q01959 2/20 0.50
DRD2 P14416 1/20 0.50
MPO P05164 1/20 0.45
MIF P14174 1/20 0.43
IDO1 P14902 2/20 0.43
AGXT P21549 2/20 0.43

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
SCHEMBL2023893 0.89 MEN1 (0.73) MEN1KMT2ATAAR1SLC6A4SLC6A3
SCHEMBL11197895 0.81 TAAR1 (0.53) TAAR1SLC6A4SLC6A3DRD2MIF
SCHEMBL6817957 0.78 MEN1 (0.62) MEN1KMT2ATAAR1SLC6A4MPO
SCHEMBL5110312 0.78 MEN1 (0.57) MEN1KMT2ATAAR1IDO1
SCHEMBL2573264 0.78 MEN1 (0.57) MEN1KMT2ATAAR1IDO1AGXT
SCHEMBL27519748 0.78 MEN1 (0.57) MEN1KMT2ATAAR1DRD2MIF
SCHEMBL3026516 0.78 TAAR1 (0.53) TAAR1SLC6A4SLC6A3DRD2IDO1
SCHEMBL9212090 0.77 TAAR1 (0.57) MEN1KMT2ATAAR1SLC6A4SLC6A3
SCHEMBL30645106 0.77 TAAR1 (0.57) MEN1KMT2ATAAR1SLC6A4SLC6A3
SCHEMBL3371633 0.77 TAAR1 (0.74) TAAR1SLC6A4SLC6A3DRD2MIF

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-1042275-A1 ANTICONVULSANT AND CENTRAL NERVOUS SYSTEM-ACTIVE BIS(FLUOROPHENYL)ALKYLAMIDES NPS PHARMACEUTICALS, INC. (US) 2000-10-11 EP disclosed
WO-1999029657-A1 ANTICONVULSANT AND CENTRAL NERVOUS SYSTEM-ACTIVE BIS(FLUOROPHENYL)ALKYLAMIDES NPS PHARMACEUTICALS, INC. (US) 1999-06-17 WO disclosed