SCHEMBL3272287

SCHEMBL3272287

NCCCCCCN.O=P(O)(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F.O=P(O)(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.47
LMNA P02545 3/20 0.41
BLM P54132 3/20 0.41
CYP3A4 P08684 1/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
PDE3A Q14432 1/20 0.40
TSHR P16473 2/20 0.38
GABBR2 O75899 2/20 0.38
GABBR1 Q9UBS5 2/20 0.38
PAOX Q6QHF9 1/20 0.38
CYP1A2 P05177 1/20 0.38
THPO P40225 1/20 0.38
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA3 P07451 2/20 0.36
CA4 P22748 2/20 0.36
CA6 P23280 2/20 0.36
CA5A P35218 2/20 0.36

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
SCHEMBL186903 0.80 PGK1 (0.45)
SCHEMBL15136324 0.77 PGK1 (0.43)
Ammonia Solution, Strong SCHEMBL6471811 0.77 PGK1 (0.43)
SCHEMBL12469733 0.77 PGK1 (0.43)
SCHEMBL4017894 0.77 PGK1 (0.43)
Phosphoric Acid SCHEMBL5177945 0.74 LMNA (0.58) FDPSLMNABLMCYP3A4NFKB1
Diaminooctane SCHEMBL31657014 0.74 LMNA (0.58) FDPSLMNABLMCYP3A4NFKB1
Phosphoric Acid SCHEMBL5382781 0.74 LMNA (0.58) FDPSLMNABLMCYP3A4NFKB1
Phosphoric Acid SCHEMBL31656949 0.74 LMNA (0.58) FDPSLMNABLMCYP3A4NFKB1
Phosphoric Acid SCHEMBL14974535 0.74 LMNA (0.58) FDPSLMNABLMCYP3A4NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1495035-B1 METHOD FOR THE PRODUCTION OF BIS(PERFLUOROALKYL)PHOSPHINIC ACIDS AND THE SALTS THEREOF MERCK PATENT GMBH (DE) 2010-06-30 EP disclosed
US-7202379-B2 Process for the preparation of bis(perfluoroalkyl)phosphinic acids and salts thereof MERCK PATENT GMBH (DE) 2007-04-10 US disclosed
US-20050256334-A1 Process for the preparation of bis(perfluoroalkyl)phosphinic acids and salts thereof MERCK PATENT GMBH (DE) 2005-11-17 US disclosed
EP-1495035-A1 METHOD FOR THE PRODUCTION OF BIS(PERFLUOROALKYL)PHOSPHINIC ACIDS AND THE SALTS THEREOF MERCK PATENT GmbH (DE) 2005-01-12 EP disclosed
WO-2003087110-A1 METHOD FOR THE PRODUCTION OF BIS(PERFLUOROALKYL)PHOSPHINIC ACIDS AND THE SALTS THEREOF MERCK PATENT GMBH (DE) 2003-10-23 WO 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-20050256334-A1 Process for the preparation of bis(perfluoroalkyl)phosphinic acids and salts thereof PFAS, PFKFB1, PFKFB4 FDPS 34/4885LMNA 3301/4885BLM 1777/4885

“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.