SCHEMBL17289237

SCHEMBL17289237

C=C(c1ccc(C)cc1)P(=O)(O)OCC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
MAPT P10636 1/20 0.43
LMNA P02545 2/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 2/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL9301199 0.85 KMT2A (0.41) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL17289013 0.85 SMN1; SMN2 (0.43) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL9714149 0.84 POLB (0.45) ALDH1A1MAPTLMNATSHRKMT2A
SCHEMBL28414250 0.75 LMNA (0.48) ALDH1A1LMNATSHRKMT2AMEN1
SCHEMBL16868436 0.73 NPSR1 (0.53) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL779323 0.71 ALDH1A1 (0.51) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL779782 0.71 ALDH1A1 (0.59) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL16868509 0.71 LMNA (0.54) ALDH1A1MAPTLMNATSHRKMT2A
SCHEMBL914541 0.69 PPARD (0.44) ALDH1A1MAPTLMNATSHRKMT2A
SCHEMBL14105717 0.69 ALDH1A1 (0.49) ALDH1A1MAPTLMNAKMT2AMEN1

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
CN-110903318-B Preparation method of alkenyl phosphonate compound 西北民族大学 2023-02-28 CN disclosed
CN-110903318-A Preparation method of alkenyl phosphonate compound 西北民族大学 2020-03-24 CN disclosed
US-9493494-B2 Phosphinine oxide derivative and preparation method thereof KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2016-11-15 US disclosed
US-20150344506-A1 NOVEL PHOSPHININE OXIDE DERIVATIVE AND PREPARATION METHOD THEREOF KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2015-12-03 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-20150344506-A1 NOVEL PHOSPHININE OXIDE DERIVATIVE AND PREPARATION METHOD THEREOF PHOSPHO1, PPIP5K2, ITPA ALDH1A1 3382/4885MAPT 4780/4885LMNA 4841/4885

“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.