SCHEMBL8550663

SCHEMBL8550663

CCc1ccc(Oc2ccccc2C=O)cc1Oc1ccccc1C=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
LMNA P02545 4/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
NPSR1 Q6W5P4 1/20 0.56
KMT2A Q03164 2/20 0.56
GAA P10253 2/20 0.56
HPGD P15428 3/20 0.46
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
AR P10275 1/20 0.41
MAPT P10636 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
SRC P12931 1/20 0.38
SLC6A4 P31645 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTR2A P28223 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL6290666 0.78 CXCL8 (0.46) ALDH1A1LMNANPSR1KMT2AHPGD
SCHEMBL31599176 0.78 LMNA (0.88) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL8544104 0.76 ALDH1A1 (0.45) ALDH1A1LMNAKMT2AHPGDSMN1; SMN2
SCHEMBL1200434 0.76 LMNA (0.68) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL4434944 0.76 LMNA (0.75) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL3144872 0.76 LMNA (0.65) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL31241185 0.76 LMNA (0.65) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL31599172 0.74 LMNA (0.72) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL9639641 0.74 LMNA (0.72) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL7920811 0.74 LMNA (0.64) ALDH1A1LMNACYP1A2CYP2C9CYP2C19

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