SCHEMBL920069

SCHEMBL920069

C[N]CCCCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.58
MIF P14174 2/20 0.58
SIGMAR1 Q99720 9/20 0.53
L3MBTL1 Q9Y468 1/20 0.50
MAOA P21397 1/20 0.50
MAPT P10636 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
HTR3A P46098 1/20 0.48

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
SCHEMBL5911061 1.00 NAAA (0.58) NAAAMIFSIGMAR1L3MBTL1MAOA
SCHEMBL919488 0.98 MIF (0.57) NAAAMIFSIGMAR1L3MBTL1MAOA
SCHEMBL919176 0.91 HTR3A (0.57) NAAAMIFSIGMAR1L3MBTL1MAOA
SCHEMBL9819828 0.84 NAAA (0.64) NAAAMIFSIGMAR1MAOAMAPT
SCHEMBL9819844 0.84 NAAA (0.64) NAAAMIFSIGMAR1MAOAMAPT
SCHEMBL9819842 0.84 NAAA (0.64) NAAAMIFSIGMAR1MAOAMAPT
SCHEMBL9819738 0.84 NAAA (0.64) NAAAMIFSIGMAR1MAOAMAPT
SCHEMBL9819790 0.84 NAAA (0.64) NAAAMIFSIGMAR1MAOAMAPT
SCHEMBL9819781 0.84 NAAA (0.64) NAAAMIFSIGMAR1MAOAMAPT
SCHEMBL9819893 0.82 NAAA (0.62) NAAAMIFSIGMAR1MAOAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6255288-B1 THERAPY FOR BONE DISORDERS NOVARTIS CORPORATION 2001-07-03 US claimed
EP-0998934-A1 REMEDIES FOR INTRAMEDULLARY DISEASES TORAY INDUSTRIES, INC. (JP) 2000-05-10 EP claimed
EP-0600834-A1 Use of methanebisphosphonic acid derivatives for the manufacture of a medicament for fracture healing CIBA-GEIGY AG (CH) 1994-06-08 EP claimed
EP-0550385-A1 Oral pharmaceutical compositions containing derivatives of methane-diphosphonic acid and 18-crown-6 ethers CIBA-GEIGY AG (CH) 1993-07-07 EP claimed
EP-0407344-A2 Pharmaceutical preparation for topical application CIBA-GEIGY AG (CH) 1991-01-09 EP claimed
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed
US-20100041694-A1 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENIC MICROBES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-18 US disclosed
WO-2008126684-A2 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-23 WO disclosed
EP-0854724-B1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 2005-03-16 EP disclosed
US-6057306-A ADMINISTERING BISPHOSPHONATES TO TREAT BONE DISEASE NOVARTIS CORPORATION (US) 2000-05-02 US disclosed
EP-0854724-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES Novartis AG (CH) 1998-07-29 EP disclosed
WO-1997012619-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 1997-04-10 WO disclosed
EP-0600834-A1 Use of methanebisphosphonic acid derivatives for the manufacture of a medicament for fracture healing CIBA-GEIGY AG (CH) 1994-06-08 EP disclosed
US-5296475-A Methanediphosphonic acids and crown compounds for treatment of bone disorders or hypercalcemia CIBA-GEIGY CORPORATION (US) 1994-03-22 US disclosed
EP-0550385-A1 Oral pharmaceutical compositions containing derivatives of methane-diphosphonic acid and 18-crown-6 ethers CIBA-GEIGY AG (CH) 1993-07-07 EP disclosed
US-5133972-A TOPICALLY ADMINISTRABLE PHARMACEUTICAL PREPARATIONS CIBA-GEIGY CORPORATION (US) 1992-07-28 US disclosed
EP-0407344-A2 Pharmaceutical preparation for topical application CIBA-GEIGY AG (CH) 1991-01-09 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-20100041694-A1 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENIC MICROBES HDHD5, NAAA, BROX NAAA 2/4885MIF 3317/4885SIGMAR1 4730/4885
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 NAAA 837/4885MIF 4024/4885SIGMAR1 3827/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 NAAA 1207/4885MIF 4568/4885SIGMAR1 3290/4885

“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.