SCHEMBL2235976

SCHEMBL2235976

O=P(O)(O)N1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
FDPS P14324 2/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP3 P08254 1/20 0.46
MMP9 P14780 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
ANPEP P15144 1/20 0.38
ERAP2 Q6P179 1/20 0.38
ALDH1A1 P00352 2/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
ALPG P10696 1/20 0.32
TSHR P16473 2/20 0.32
GFER P55789 1/20 0.32

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
SCHEMBL8028936 1.00 MAPT (0.46) MAPTFDPSMMP1MMP2MMP3
SCHEMBL28736797 1.00 MAPT (0.46) MAPTFDPSMMP1MMP2MMP3
Bromide SCHEMBL28820215 0.97 MAPT (0.44) MAPTFDPSMMP1MMP2MMP3
Hydrochloric Acid SCHEMBL28020247 0.97 MAPT (0.44) MAPTFDPSMMP1MMP2MMP3
SCHEMBL237224 0.90
Phosphonic Acid SCHEMBL608064 0.89 FDPS (0.39) MAPTFDPSMMP1MMP2MMP3
SCHEMBL3392230 0.83 FDPS (0.33) MAPTFDPSMMP1MMP2MMP3
SCHEMBL15536892 0.83 FDPS (0.33) MAPTFDPSMMP1MMP2MMP3
SCHEMBL654555 0.83
SCHEMBL1299741 0.78 FDPS (0.42) MAPTFDPSMMP1MMP2MMP3

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
EP-2389183-B1 PHOSPHATE MANAGEMENT WITH SMALL MOLECULES OPKO IRELAND GLOBAL HOLDINGS LTD (IE) 2017-05-31 EP disclosed
CN-103923143-B Method for synthesizing dinucleoside tetraphosphate and P2,P3-(dihalo) methylene dinucleoside tetraphosphate 江西科技师范大学 2017-01-11 CN disclosed
US-9198923-B2 Phosphate management with small molecules Opko Ireland Global Holdings, Ltd. (KY) 2015-12-01 US disclosed
CN-103923143-A A method for synthesizing dinucleotide tetraphosphoric acid and P2, P3-(dihalo) methylene dinucleotide tetraphosphoric acid UNIV JIANGXI NORMAL SCI & TECH 2014-07-16 CN disclosed
US-20120028926-A1 Phosphate Management with Small Molecules CYTOCHROMA INC. (CA) 2012-02-02 US disclosed
US-7981874-B2 Phosphorus derivatives as histone deacetylase inhibitors MERCK SHARP & DOHME CORP. (US) 2011-07-19 US disclosed
US-20090270351-A1 PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS MERCK SHARP & DOHME CORP. 2009-10-29 US disclosed
EP-2049124-A2 PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS Merck & Co., Inc. (US) 2009-04-22 EP disclosed
US-7368439-B2 Dinucleoside poly(borano)phosphate derivatives and uses thereof BAR - ILAN UNIVERSITY (IL) 2008-05-06 US disclosed
WO-2008010985-A2 PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS MERCK & CO., INC. (US) 2008-01-24 WO disclosed
US-20060287271-A1 Dinucleoside poly(borano)phosphate derivatives and uses thereof BAR-ILAN UNIVERSITY (IL) 2006-12-21 US disclosed
CN-1649885-A Cellular Accumulation of Phosphonate Analogs of HIV Protease Inhibitor Compounds and Such Compounds GILEAD SCIENCES INC (US) 2005-08-03 CN disclosed
EP-0602068-B1 PROCESS FOR INCREASING POLYAMIDE MOLECULAR WEIGHT WITH ORGANOPHOSPHONIC ACID OR ESTER CATALYSTS IN THE PRESENCE OF ALUMINA-CONTAINING TiO 2? DU PONT (US) 1997-04-23 EP disclosed
EP-0602068-A1 PROCESS FOR INCREASING POLYAMIDE MOLECULAR WEIGHT WITH ORGANOPHOSPHONIC ACID OR ESTER CATALYSTS IN THE PRESENCE OF ALUMINA-CONTAINING TiO 2?. DU PONT (US) 1994-06-22 EP disclosed
EP-0353969-B1 Catalytic amidation process DU PONT (US) 1994-06-08 EP disclosed
WO-1993005086-A2 PROCESS FOR INCREASING POLYAMIDE MOLECULAR WEIGHT WITH ORGANOPHOSPHONIC ACID OR ESTER CATALYSTS IN THE PRESENCE OF ALUMINA-CONTAINING TiO¿2? E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-03-18 WO disclosed
US-5142000-A Process for increasing polyamide molecular weight with organophosphonic acid or ester catalysts in the presence of alumina-containing titanium dioxide E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-25 US disclosed
US-4912175-A Heating E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-03-27 US disclosed
WO-1990001513-A1 CATALYTIC AMIDATION PROCESS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-22 WO disclosed
EP-0353969-A1 Catalytic amidation process E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-07 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-20120028926-A1 Phosphate Management with Small Molecules SLC34A2, PHPT1, SLC34A3 MAPT 1907/4885FDPS 289/4885MMP1 899/4885
US-20060287271-A1 Dinucleoside poly(borano)phosphate derivatives and uses thereof P2RY2, P2RY1, P2RY11 MAPT 4878/4885FDPS 535/4885MMP1 2969/4885
US-20090270351-A1 PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC5, PPM1A, PTEN MAPT 1326/4885FDPS 3007/4885MMP1 560/4885

“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.