SCHEMBL171269

SCHEMBL171269

O=P(O)(CCCCCCCCP(=O)(O)c1ccccc1)c1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.78
ALDH1A1 P00352 3/20 0.61
NPSR1 Q6W5P4 2/20 0.61
GAA P10253 2/20 0.61
MAPT P10636 1/20 0.61
ALPG P10696 1/20 0.61
ALOX12 P18054 1/20 0.61
NPY1R P25929 1/20 0.61
HTT P42858 1/20 0.61
NPY2R P49146 1/20 0.61
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA5A P35218 1/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
TSHR P16473 2/20 0.48
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CETP P11597 2/20 0.44
ALOX15 P16050 1/20 0.43

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
SCHEMBL14287997 0.98 CFTR (0.82) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL14287873 0.92 CFTR (0.67) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL6440843 0.90 CFTR (0.64) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL3817404 0.90 CFTR (0.64) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL18486462 0.90 CFTR (0.64) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL6446482 0.90 CFTR (0.64) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL971677 0.90 CFTR (0.64) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL7931533 0.90 CFTR (0.64) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL6442166 0.90 CFTR (0.64) CFTRALDH1A1NPSR1GAAMAPT
SCHEMBL14287628 0.89 NPSR1 (0.72) CFTRALDH1A1NPSR1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2660266-A2 Solid state polymerization process for polyester with phosphinic acid compounds BASF SE (DE) 2013-11-06 EP disclosed
US-8436131-B2 Solid state polymerization process for polyester with phosphinic acid compounds BASF SE (DE) 2013-05-07 US disclosed
US-8436131-B2 Solid state polymerization process for polyester with phosphinic acid compounds BASF SE (DE) 2013-05-07 US disclosed
US-20130035451-A1 Solid State Polymerization Process for Polyester with Phosphinic Acid Compounds BASF SE (DE) 2013-02-07 US disclosed
US-20130035451-A1 Solid State Polymerization Process for Polyester with Phosphinic Acid Compounds BASF SE (DE) 2013-02-07 US disclosed
US-8258253-B2 Solid state polymerization process for polyester with phosphinic acid compounds BASF SE (DE) 2012-09-04 US disclosed
US-8258253-B2 Solid state polymerization process for polyester with phosphinic acid compounds BASF SE (DE) 2012-09-04 US disclosed
EP-2426161-A1 Solid State Polymerization Process for Polyester with Phosphinic Acid Compounds BASF SE (DE) 2012-03-07 EP disclosed
US-8030435-B2 Solid state polymerization process for polyester with phosphinic acid compounds CIBA CORPORATION (US) 2011-10-04 US disclosed
US-8030435-B2 Solid state polymerization process for polyester with phosphinic acid compounds CIBA CORPORATION (US) 2011-10-04 US disclosed
EP-2268699-B1 SOLID STATE POLYMERIZATION PROCESS FOR POLYESTER WITH PHOSPHINIC ACID COMPOUNDS BASF SE (DE) 2011-09-28 EP disclosed
WO-2009121796-A1 SOLID STATE POLYMERIZATION PROCESS FOR POLYESTER WITH PHOSPHINIC ACID COMPOUNDS BASF SE (DE) 2009-10-08 WO disclosed
US-20090253888-A1 Solid state polymerization process for polyester with phosphinic acid compounds CIBA CORPORATION 2009-10-08 US disclosed
US-20090253888-A1 Solid state polymerization process for polyester with phosphinic acid compounds CIBA CORPORATION 2009-10-08 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 (1 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-20130035451-A1 Solid State Polymerization Process for Polyester with Phosphinic Acid Compounds PHOSPHO1, PIK3C2A, PIK3C2B CFTR 4298/4885ALDH1A1 2966/4885NPSR1 2125/4885

“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.