SCHEMBL823552

SCHEMBL823552

O=C(NCCCCCCNC(=O)c1ccccc1O)c1ccccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.84
ALOX5 P09917 3/20 0.77
HTT P42858 3/20 0.73
TSHR P16473 2/20 0.73
NPC1 O15118 1/20 0.73
ALDH1A1 P00352 1/20 0.73
MAPT P10636 1/20 0.73
HPGD P15428 1/20 0.73
NPSR1 Q6W5P4 1/20 0.73
HSD17B10 Q99714 1/20 0.73
NLRP1 Q9C000 1/20 0.73
NAMPT P43490 1/20 0.68
HDAC7 Q8WUI4 1/20 0.61
KDM4E B2RXH2 2/20 0.57
MPO P05164 1/20 0.57
GAA P10253 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HIF1A Q16665 1/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55

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
Hydrochloric Acid SCHEMBL15769552 0.92 HTT (0.73) NAAAALOX5HTTTSHRNPC1
SCHEMBL3155982 0.92 NAAA (1.00) NAAAALOX5HTTTSHRNPC1
SCHEMBL13385674 0.92 NAAA (0.72) NAAAALOX5HTTTSHRNPC1
SCHEMBL1543662 0.92 NAAA (0.72) NAAAALOX5HTTTSHRNPC1
SCHEMBL9662113 0.92 NAAA (1.00) NAAAALOX5HTTTSHRNPC1
SCHEMBL360518 0.92 NAAA (1.00) NAAAALOX5HTTTSHRNPC1
SCHEMBL13385681 0.92 NAAA (0.72) NAAAALOX5HTTTSHRNPC1
SCHEMBL359901 0.92 NAAA (1.00) NAAAALOX5HTTTSHRNPC1
SCHEMBL10705645 0.92 NAAA (1.00) NAAAALOX5HTTTSHRNPC1
SCHEMBL3289794 0.92 NAAA (0.72) NAAAALOX5HTTTSHRNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2714924-B1 HDAC Inhibitors for use in the treatment of Gaucher's disease, von Hippel-Lindau disease, phaeochromocytoma and paragangliomas. LIXTE BIOTECHNOLOGY INC (US) 2018-03-21 EP disclosed
EP-2318005-B1 NEUROPROTECTIVE AGENTS FOR THE PREVENTION AND TREATMENT OF NEURODEGENERATIVE DISEASES LIXTE BIOTECHNOLOGY INC (US) 2017-11-01 EP disclosed
EP-2200439-B1 HDAC INHIBITORS LIXTE BIOTECHNOLOGY INC (US) 2017-03-22 EP disclosed
US-20160008336-A1 HDAC INHIBITORS FOR THE TREATMENT OF TRAUMATIC BRAIN INJURY LIXTE BIOTECHNOLOGY, INC. (US) 2016-01-14 US disclosed
WO-2014137741-A1 HDAC INHIBITORS FOR TREATING TRAUMATIC BRAIN INJURY LIXTE BIOTECHNOLOGY, INC. (US) 2014-09-12 WO disclosed
US-20140235649-A1 USE OF PHOSPHATASE INHIBITORS OR HISTONE DEACETYLASE INHIBITORS TO TREAT DISEASES CHARACTERIZED BY LOSS OF PROTEIN FUNCTION LIXTE BIOTECHNOLOGY, INC. (US) 2014-08-21 US disclosed
US-8455688-B2 HDAC inhibitors LIXTE BIOTECHNOLOGY, INC. (US) 2013-06-04 US disclosed
US-8455688-B2 HDAC inhibitors LIXTE BIOTECHNOLOGY, INC. (US) 2013-06-04 US disclosed
US-8329719-B2 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. (US) 2012-12-11 US disclosed
WO-2012162535-A1 USE OF PHOSPHATASE INHIBITORS OR HISTONE DEACETYLASE INHIBITORS TO TREAT DISEASES CHARACTERIZED BY LOSS OF PROTEIN FUNCTION LIXTE BIOTECHNOLOGY, INC. (US) 2012-11-29 WO disclosed
US-8058268-B2 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. (US) 2011-11-15 US disclosed
WO-2010014220-A1 NEUROPROTECTIVE AGENTS FOR THE PREVENTION AND TREATMENT OF NEURODEGENERATIVE DISEASES LIXTE BIOTECHNOLOGY, INC. (US) 2010-02-04 WO disclosed
US-20100029640-A1 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. 2010-02-04 US disclosed
US-20100029640-A1 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. 2010-02-04 US disclosed
US-20090143445-A1 HDAC Inhibitors JOHN P. WHITE, ESQ 2009-06-04 US disclosed
WO-2009045440-A1 HDAC INHIBITORS LIXTE BIOTECHNOLOGY HOLDINGS, INC. (US) 2009-04-09 WO disclosed
US-5191003-A Diamide compound, improved tire gripping, vibration insulation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-02 US disclosed
EP-0470776-A1 Rubber composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-02-12 EP disclosed
EP-0137074-A1 Curable compositions containing epoxy resins and salicyloyl hydrocarbylamines and cured compositions thereof THE DOW CHEMICAL COMPANY (US) 1985-04-17 EP disclosed
US-4410681-A Epoxy resins cured with salicyloyl hydrocarbylamines THE DOW CHEMICAL COMPANY (US) 1983-10-18 US 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-20100029640-A1 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases SNCA, NLN, HTT NAAA 1015/4885ALOX5 2186/4885HTT 3/4885
US-20160008336-A1 HDAC INHIBITORS FOR THE TREATMENT OF TRAUMATIC BRAIN INJURY HDAC5, HDAC1, HDAC4 NAAA 729/4885ALOX5 4091/4885HTT 2208/4885
US-20140235649-A1 USE OF PHOSPHATASE INHIBITORS OR HISTONE DEACETYLASE INHIBITORS TO TREAT DISEASES CHARACTERIZED BY LOSS OF PROTEIN FUNCTION HDAC1, PPP3CA, PPM1A NAAA 1843/4885ALOX5 4680/4885HTT 558/4885
US-20090143445-A1 HDAC Inhibitors HDAC3, HDAC7, HDAC4 NAAA 2802/4885ALOX5 2923/4885HTT 731/4885

“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.