SCHEMBL95682

SCHEMBL95682

[CH2]c1ccc(NC(=O)Oc2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.70
MAPT P10636 5/20 0.70
RAD51 Q06609 1/20 0.68
KMT2A Q03164 5/20 0.64
MEN1 O00255 3/20 0.64
KDM4E B2RXH2 3/20 0.64
THRB P10828 2/20 0.64
GFER P55789 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
GAA P10253 4/20 0.62
LMNA P02545 1/20 0.62
TP53 P04637 1/20 0.62
HTT P42858 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
USP2 O75604 1/20 0.56
RAB9A P51151 1/20 0.55
FAAH O00519 6/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HPGD P15428 1/20 0.55
CYP1A2 P05177 1/20 0.54

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
SCHEMBL1376459 0.93 ALDH1A1 (0.70) ALDH1A1MAPTRAD51KMT2AMEN1
SCHEMBL8063648 0.91 ALDH1A1 (0.82) ALDH1A1MAPTRAD51KMT2AMEN1
Phenyl Phenylcarbamate SCHEMBL272994 0.87 ALDH1A1 (0.76) ALDH1A1MAPTRAD51KMT2AMEN1
SCHEMBL21295428 0.84 SMN1; SMN2 (0.74) ALDH1A1MAPTRAD51KMT2AMEN1
SCHEMBL9125722 0.84 ALDH1A1 (0.75) ALDH1A1MAPTRAD51KMT2AMEN1
SCHEMBL30407133 0.84 ALDH1A1 (0.72) ALDH1A1MAPTRAD51KMT2AMEN1
SCHEMBL9480551 0.84 ALDH1A1 (0.72) ALDH1A1MAPTRAD51KMT2AMEN1
SCHEMBL95577 0.83 ALDH1A1 (0.53) ALDH1A1MAPTRAD51KMT2AMEN1
SCHEMBL94538 0.83 SMN1; SMN2 (0.71) ALDH1A1MAPTKMT2AMEN1KDM4E
SCHEMBL97442 0.83 GAA (0.51) ALDH1A1MAPTRAD51KMT2AMEN1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6630512-B2 Antiinflammatory agents; autoimmune disease BIOGEN, INC. 2003-10-07 US claimed
US-20030018016-A1 Cell adhesion inhibitors BIOGEN IDEC MA, INC. 2003-01-23 US claimed
EP-0805796-B1 CELL ADHESION INHIBITORS BIOGEN INC (US) 2002-12-11 EP claimed
US-6376538-B1 ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASES BIOGEN, INC. 2002-04-23 US claimed
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
EP-2043644-A1 NF- B INHIBITOR Otsuka Pharmaceutical Co., Ltd. (JP) 2009-04-08 EP disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
US-20060166866-A1 Cell adhesion inhibitors BIOGEN, INC., A MASSACHUSETTS CORPORATION 2006-07-27 US disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO disclosed
US-6630512-B2 Antiinflammatory agents; autoimmune disease BIOGEN, INC. 2003-10-07 US disclosed
US-20030018016-A1 Cell adhesion inhibitors BIOGEN IDEC MA, INC. 2003-01-23 US disclosed
EP-0805796-B1 CELL ADHESION INHIBITORS BIOGEN INC (US) 2002-12-11 EP disclosed
US-6376538-B1 ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASES BIOGEN, INC. 2002-04-23 US disclosed
EP-0805796-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1997-11-12 EP disclosed
WO-1996022966-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1996-08-01 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 (4 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-20060166866-A1 Cell adhesion inhibitors ICAM1, VCAM1, EPCAM ALDH1A1 450/4885MAPT 2771/4885RAD51 2626/4885
US-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB ALDH1A1 2948/4885MAPT 4112/4885RAD51 2038/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 ALDH1A1 2458/4885MAPT 4773/4885RAD51 781/4885
US-20030018016-A1 Cell adhesion inhibitors ICAM1, VCAM1, EPCAM ALDH1A1 450/4885MAPT 2771/4885RAD51 2626/4885

“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.