SCHEMBL97010

SCHEMBL97010

OCc1nnnn1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.60
PKM P14618 2/20 0.60
NLRP3 Q96P20 1/20 0.60
HSD11B1 P28845 4/20 0.56
ALDH1A1 P00352 12/20 0.54
LMNA P02545 4/20 0.54
KMT2A Q03164 3/20 0.54
THRB P10828 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 2/20 0.51
TSHR P16473 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
POLB P06746 2/20 0.49
MAPT P10636 2/20 0.49
HPGD P15428 2/20 0.49
CCR6 P51684 1/20 0.49
CACNA1B Q00975 1/20 0.49
APBA1 Q02410 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.47

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
SCHEMBL2968359 0.85 HSD11B1 (0.61) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL4675275 0.84 HSD11B1 (0.64) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL15452739 0.84 HTT (0.64) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL12974407 0.83 ALDH1A1 (0.45) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL18323499 0.82 HSD11B1 (0.55) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL2212836 0.81 ALDH1A1 (0.69) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL27959558 0.81 HTT (0.60) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL10934021 0.81 HTT (0.60) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL156901 0.81 HTT (0.60) HTTPKMNLRP3HSD11B1ALDH1A1
SCHEMBL5545310 0.81 HTT (0.60) HTTPKMNLRP3HSD11B1ALDH1A1

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 13 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-7857985-B2 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2010-12-28 US disclosed
US-7857985-B2 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2010-12-28 US 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-20070186484-A1 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2007-08-16 US disclosed
US-20070186484-A1 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2007-08-16 US disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
US-5703075-A Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones PHARMACIA & UPJOHN COMPANY (US) 1997-12-30 US disclosed
EP-0489877-B1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES UPJOHN CO (US) 1995-09-20 EP 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 HTT 4495/4885PKM 3397/4885NLRP3 2126/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 HTT 4175/4885PKM 2789/4885NLRP3 2113/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 HTT 4175/4885PKM 2789/4885NLRP3 2113/4885

“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.