SCHEMBL14397396

SCHEMBL14397396

Cc1ccccc1Oc1cccc(C(F)(F)F)c1F

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.48
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BCAT1 P54687 4/20 0.39
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
HSD11B1 P28845 2/20 0.37
SCN8A Q9UQD0 1/20 0.37
BCAT2 O15382 2/20 0.36
MPL P40238 1/20 0.36
MRGPRX1 Q96LB2 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.35

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
SCHEMBL28468855 0.87 IDO1 (0.41) ARIDO1TDO2HSD11B1MPL
SCHEMBL10902334 0.85 AR (0.53) ARMEN1KMT2ANPC1TSHR
SCHEMBL476650 0.77 MPL (0.44) ARIDO1TDO2HSD11B1SCN8A
SCHEMBL4511619 0.76 AR (0.44) ARTSHRSMN1; SMN2IDO1TDO2
SCHEMBL14649864 0.75 L3MBTL1 (0.40) ARNPC1RAB9ASMN1; SMN2
SCHEMBL29185416 0.75 TSHR (0.56) ARMEN1KMT2ANPC1TSHR
SCHEMBL30833846 0.75 TSHR (0.40) MEN1KMT2ANPC1TSHRRAB9A
SCHEMBL17355805 0.74 MEN1 (0.40) MEN1KMT2AGPBAR1
SCHEMBL14397648 0.74 AR (0.44) AR
SCHEMBL29637724 0.74 TSHR (0.65) ARMEN1KMT2ANPC1TSHR

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-2007113327-A2 FUNGICIDE N-CYCLOPROPYL-SULFONYLAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2007-10-11 WO disclosed