SCHEMBL6139066

SCHEMBL6139066

N=P(N)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.39
CA4 P22748 2/20 0.39
CA5A P35218 2/20 0.39
TSHR P16473 2/20 0.35
ESR1 P03372 3/20 0.35
ESR2 Q92731 2/20 0.35
CFTR P13569 1/20 0.35
MAPT P10636 2/20 0.33
GAA P10253 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALPG P10696 1/20 0.33
ALOX12 P18054 1/20 0.33
NPY1R P25929 1/20 0.33
HTT P42858 1/20 0.33
NPY2R P49146 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
F2 P00734 1/20 0.33
F10 P00742 1/20 0.33

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
SCHEMBL6832596 0.81 CA2 (0.39) CA2CA4CA5ATSHRESR1
SCHEMBL7078417 0.77 CA2 (0.36) CA2CA4CA5ATSHRESR1
SCHEMBL28459717 0.73 CA2 (0.43) CA2CA4CA5ATSHRESR1
SCHEMBL361668 0.73 CA2 (0.43) CA2CA4CA5ATSHRESR1
SCHEMBL2932036 0.72 CA2 (0.47) CA2CA4CA5ATSHRESR1
Water SCHEMBL7532602 0.71 CA2 (0.41) CA2CA4CA5ATSHRESR1
Hydrochloric Acid SCHEMBL2582115 0.71 CA2 (0.41) CA2CA4CA5ATSHRESR1
Hydrochloric Acid SCHEMBL996153 0.71 CA2 (0.41) CA2CA4CA5ATSHRESR1
Fluoride SCHEMBL11191593 0.71 CA2 (0.41) CA2CA4CA5ATSHRESR1
SCHEMBL6316218 0.71 CA2 (0.41) CA2CA4CA5ATSHRESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050282982-A1 Amido complexes of vanadium for olefin polymerization LANXESS DEUTSCHLAND GMBH (DE) 2005-12-22 US disclosed
EP-1607397-A1 Vanadium-amido complexes for olefin polymerization Lanxess Deutschland GmbH (DE) 2005-12-21 EP disclosed
EP-1284270-B1 Vanadium-Imido-Phosphoraniminato complexes for olefin polymerisation BAYER AG (DE) 2005-06-29 EP disclosed
US-6846769-B2 Vanadium-imido-phosphoraneiminato complexes for the polymerization of olefins BAYER AKTIENGESELLSCHAFT (DE) 2005-01-25 US disclosed
US-20030114675-A1 Vanadium-imido-phosphoraneiminato complexes for the polymerization of olefins LANXESS DEUTSCHLAND GMBH (DE) 2003-06-19 US disclosed
EP-1284270-A1 Vanadium-Imido-Phosphoraniminato complexes for olefin polymerisation BAYER AG (DE) 2003-02-19 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 (2 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-20030114675-A1 Vanadium-imido-phosphoraneiminato complexes for the polymerization of olefins MVD, PPIP5K2, PI4KA CA2 4297/4885CA4 3424/4885CA5A 4599/4885
US-20050282982-A1 Amido complexes of vanadium for olefin polymerization NOX4, NOXO1, COG4 CA2 4160/4885CA4 1518/4885CA5A 2742/4885

“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.