SCHEMBL97368

SCHEMBL97368

[O]CCCCCOCCCCCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MAPT P10636 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SIGMAR1 Q99720 2/20 0.47
IDO1 P14902 1/20 0.47
FFAR1 O14842 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
FAAH O00519 3/20 0.46
CES1 P23141 3/20 0.46

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
SCHEMBL96691 1.00 TDP1 (0.53) TDP1L3MBTL1MAPTRXFP1MEN1
SCHEMBL97037 0.98 TDP1 (0.50) TDP1L3MBTL1MAPTRXFP1MEN1
SCHEMBL626848 0.90 TDP1 (0.61) TDP1L3MBTL1MAPTRXFP1MEN1
SCHEMBL7449325 0.90 TDP1 (0.61) TDP1L3MBTL1MAPTRXFP1MEN1
SCHEMBL7449055 0.90 TDP1 (0.61) TDP1L3MBTL1MAPTRXFP1MEN1
SCHEMBL8048487 0.90 TDP1 (0.61) TDP1L3MBTL1MAPTRXFP1MEN1
SCHEMBL7448881 0.90 TDP1 (0.61) TDP1L3MBTL1MAPTRXFP1MEN1
SCHEMBL97040 0.88 IDO1 (0.55) MEN1KMT2ASIGMAR1IDO1FFAR1
SCHEMBL94958 0.88 MAPT (0.59) MAPTRXFP1SIGMAR1
SCHEMBL1006478 0.88 MAPT (0.59) MAPTRXFP1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 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 (3 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-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB TDP1 3588/4885L3MBTL1 1099/4885MAPT 4112/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 TDP1 4079/4885L3MBTL1 262/4885MAPT 4773/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 TDP1 4079/4885L3MBTL1 262/4885MAPT 4773/4885

“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.