SCHEMBL456375

SCHEMBL456375

O=C(Cl)c1cc(Br)sc1Cl

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DAO P14920 5/20 0.42
GSK3B P49841 5/20 0.38
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GPR35 Q9HC97 1/20 0.32
RAB9A P51151 2/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
CES2 O00748 2/20 0.31
CES1 P23141 2/20 0.31
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30
NPC1 O15118 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL157848 0.83 DAO (0.63) DAOGSK3BKDM4EGPR35ALDH1A1
SCHEMBL8652678 0.81 DAO (0.41) DAOGSK3BMAPTKDM4EMAPK1
SCHEMBL28713332 0.80 GSK3B (0.35) DAOGSK3BCES2CES1ALDH1A1
SCHEMBL377802 0.77 DAO (0.68) DAOGSK3BMAPTKDM4EHPGD
SCHEMBL456389 0.77 GSK3B (0.39) DAOGSK3BMAPTKDM4ECES2
SCHEMBL20269630 0.76 ABL1 (0.42) DAOMAPTKDM4EHPGDMAPK1
SCHEMBL8629487 0.74 DAO (0.35) DAOGSK3BMAPTKDM4EHPGD
SCHEMBL11845870 0.70 DAO (0.52) DAOGSK3BMAPTKDM4EHPGD
SCHEMBL16236459 0.69 DAO (0.38) DAOGSK3BMAPTKDM4EHPGD
SCHEMBL11880888 0.67 RAB9A (0.49) DAOGSK3BMAPTKDM4EHPGD

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
US-9006187-B2 Thiophene derivative as SGLT2 inhibitor and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2015-04-14 US disclosed
US-20130172278-A1 NOVEL THIOPHENE DERIVATIVE AS SGLT2 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2013-07-04 US disclosed
WO-2012033390-A2 NOVEL THIOPHENE DERIVATIVE AS SGLT2 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2012-03-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130172278-A1 NOVEL THIOPHENE DERIVATIVE AS SGLT2 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME SLC5A2, SLC5A1, SLC2A2 DAO 2523/4885GSK3B 1701/4885MAPT 1135/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.