SCHEMBL16600552

SCHEMBL16600552

CCOc1ccc(Cc2ccc[c]c2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SLC5A2 P31639 11/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
DHFR P00374 1/20 0.43
NQO1 P15559 1/20 0.42
SLC5A1 P13866 6/20 0.41
LMNA P02545 2/20 0.41
ADRA2A P08913 1/20 0.40
SLC5A11 Q8WWX8 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL16600894 0.83 SLC5A2 (0.44) MEN1KMT2ASLC5A2SMN1; SMN2KDM4E
SCHEMBL16600597 0.81 PIK3CD (0.36) SLC5A2ALDH1A1
SCHEMBL16600909 0.81 ACACB (0.34) SLC5A2LMNA
SCHEMBL16600928 0.78 SLC5A2 (0.41) SLC5A2SLC5A1
SCHEMBL16600577 0.78 SLC6A4 (0.52) MEN1KMT2ASLC5A2SLC5A1ALDH1A1
SCHEMBL3622807 0.78 MEN1 (0.66) MEN1KMT2ASLC5A2SMN1; SMN2KDM4E
SCHEMBL7463754 0.77 HTR2A (0.42) MEN1KMT2ASMN1; SMN2HPGDALDH1A1
SCHEMBL21198742 0.76 KEAP1 (0.52) MEN1KMT2ASLC5A2HPGDSLC5A1
SCHEMBL7785326 0.73 NQO1 (0.47) MEN1KMT2ASMN1; SMN2KDM4EHPGD
SCHEMBL16600692 0.73 SLC5A2 (0.47) MEN1KMT2ASLC5A2SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112014494-A Method for separating eggliflozin and isomer thereof 上海柏狮生物科技有限公司 2020-12-01 CN disclosed
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