SCHEMBL20879620

SCHEMBL20879620

CCOc1ccc(P(=O)(O)c2ccc(OCC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.58
PLK1 P53350 1/20 0.52
TSHR P16473 2/20 0.50
LMNA P02545 2/20 0.50
PARP10 Q53GL7 1/20 0.50
LTA4H P09960 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 1/20 0.47
POLB P06746 1/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
PRSS1 P07477 1/20 0.46

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
SCHEMBL2470629 0.93 LTA4H (0.53) NQO1PLK1LMNALTA4HTDP1
SCHEMBL7213299 0.88 NQO1 (0.58) NQO1PLK1TSHRLMNAPARP10
SCHEMBL11175437 0.79 NQO1 (0.58) NQO1PLK1TSHRLMNAPARP10
SCHEMBL21389870 0.79 NQO1 (0.58) NQO1PLK1TSHRLMNAPARP10
SCHEMBL8386717 0.79 BLM (0.61) NQO1PLK1TSHRLMNAPARP10
Phosphoric Acid SCHEMBL28053197 0.78 TDP1 (0.76) NQO1PLK1TSHRLMNAPARP10
SCHEMBL28483178 0.78 BLM (0.59) NQO1PLK1TSHRLMNAPARP10
Phenetole SCHEMBL28048881 0.77 LTA4H (0.63) NQO1PLK1LMNALTA4HNPC1
1,4-Diethoxybenzene SCHEMBL124015 0.76 NQO1 (1.00) NQO1PLK1TSHRPARP10LTA4H
1,4-Diethoxybenzene SCHEMBL28186701 0.76 NQO1 (1.00) NQO1PLK1TSHRPARP10LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3832763-A1 POSITIVE ELECTRODE ACTIVE MATERIAL FOR MAGNESIUM BATTERIES FUJIFILM Wako Pure Chemical Corporation (JP) 2021-06-09 EP disclosed
US-10862169-B2 Phosphorus electrolytic solution containing magnesium ions FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2020-12-08 US disclosed
US-20190296396-A1 PHOSPHORUS ELECTROLYTIC SOLUTION CONTAINING MAGNESIUM IONS FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-09-26 US disclosed
EP-3467931-A1 PHOSPHORUS ELECTROLYTIC SOLUTION CONTAINING MAGNESIUM IONS FUJIFILM Wako Pure Chemical Corporation (JP) 2019-04-10 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-10862169-B2 Phosphorus electrolytic solution containing magnesium ions PEF1, RER1, AFF1 NQO1 4167/4885PLK1 1505/4885TSHR 748/4885
US-20190296396-A1 PHOSPHORUS ELECTROLYTIC SOLUTION CONTAINING MAGNESIUM IONS PEF1, RER1, AFF1 NQO1 4167/4885PLK1 1505/4885TSHR 748/4885

“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.