SCHEMBL16600577

SCHEMBL16600577

FC(F)(F)Oc1ccc(Cc2ccc[c]c2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.52
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
MPO P05164 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TRPV1 Q8NER1 2/20 0.37
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
SLC5A2 P31639 2/20 0.35
SCN8A Q9UQD0 1/20 0.35
SLC5A1 P13866 1/20 0.35
GRIN2B Q13224 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
SCHEMBL16600597 0.83 PIK3CD (0.36) SLC6A4ALDH1A1FFAR1FFAR4MAPT
SCHEMBL28194119 0.78 SLC6A4 (0.61) SLC6A4CYP11B1CYP11B2MPOALDH1A1
SCHEMBL16600552 0.78 MEN1 (0.46) ALDH1A1MEN1KMT2ASLC5A2SLC5A1
SCHEMBL16600909 0.77 ACACB (0.34) SLC6A4SLC5A2
SCHEMBL7463754 0.76 HTR2A (0.42) ALDH1A1MEN1KMT2A
SCHEMBL21198742 0.74 KEAP1 (0.52) MEN1MAPTKMT2ASLC5A2SLC5A1
SCHEMBL16600894 0.73 SLC5A2 (0.44) ALDH1A1MEN1KMT2ASLC5A2SLC5A1
SCHEMBL2092054 0.73 SLC6A4 (0.56) SLC6A4CYP11B1CYP11B2MPOALDH1A1
SCHEMBL2096216 0.72 SLC6A4 (0.49) SLC6A4CYP11B1CYP11B2MPOALDH1A1
SCHEMBL2575166 0.72 SLC6A4 (0.61) SLC6A4CYP11B1CYP11B2MPOTRPV1

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-2895490-A1 GLUCOPYRANOSYL DERIVATIVES AND THEIR USES IN MEDICINE Sunshine Lake Pharma Co., Ltd. (CN) 2015-07-22 EP disclosed
WO-2015043511-A1 GLUCOPYRANOSYL DERIVATIVES AND THEIR USES IN MEDICINE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-04-02 WO disclosed