SCHEMBL8549679

SCHEMBL8549679

O=Cc1ccc(Oc2cccc(Oc3ccc(C=O)c(Cl)c3)c2)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
KMO O15229 1/20 0.46
ALDH1A1 P00352 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
MITF O75030 1/20 0.42
GFER P55789 1/20 0.42
NLRP1 Q9C000 1/20 0.42
NOD2 Q9HC29 1/20 0.42
TRIM24 O15164 1/20 0.41
TYR P14679 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41
LMNA P02545 3/20 0.39
ADAMTS5 Q9UNA0 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL25333119 0.93 ALDH1A1 (0.53) TDP1ALDH1A1SMN1; SMN2MAPTTRIM24
SCHEMBL25333237 0.91 TDP1 (0.56) TDP1KMOALDH1A1MAPTLMNA
SCHEMBL7762056 0.91 LMNA (0.50) TDP1KMOALDH1A1SMN1; SMN2KMT2A
SCHEMBL3303519 0.89 ALDH1A1 (0.50) TDP1KMOALDH1A1KMT2AGAA
SCHEMBL25332266 0.89 TDP1 (0.44) TDP1KMOALDH1A1SMN1; SMN2MAPT
SCHEMBL15809138 0.85 TDP1 (0.62) TDP1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL875857 0.85 POLB (0.50) TDP1ALDH1A1MAPTCHEK2RAB9A
SCHEMBL3122711 0.84 MAOB (0.56) TDP1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL3302672 0.82 FDFT1 (0.42) TDP1KMOALDH1A1SMN1; SMN2KMT2A
SCHEMBL6142827 0.82 TDP1 (0.48) TDP1ALDH1A1KMT2AGAATRIM24

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
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed