SCHEMBL19008259

SCHEMBL19008259

C=C(CP(=O)(OC)OCC)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
LMNA P02545 2/20 0.45
NPSR1 Q6W5P4 1/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
NR1I2 O75469 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KCNH2 Q12809 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ACHE P22303 1/20 0.37
CA2 P00918 1/20 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
SCHEMBL7900085 0.92 POLB (0.44) POLBLMNANPSR1MAPTMAPK1
SCHEMBL1305579 0.73 POLB (0.59) POLBLMNANPSR1MAPTMAPK1
SCHEMBL7738531 0.73 TSHR (0.44) POLBLMNANPSR1MAPTMAPK1
SCHEMBL29846372 0.71 NPSR1 (0.46) POLBNPSR1MAPTMAPK1NR1I2
SCHEMBL7738533 0.71 NR1I2 (0.53) POLBLMNANPSR1MAPTNR1I2
SCHEMBL9714149 0.70 POLB (0.45) POLBLMNANPSR1MAPTNR1I2
SCHEMBL24371342 0.70 MEN1 (0.49) POLBLMNANPSR1MAPTNR1I2
SCHEMBL425583 0.69 NR1I2 (0.54) POLBLMNANPSR1MAPTMAPK1
SCHEMBL5734842 0.69 POLB (0.73) POLBLMNANPSR1MAPTMAPK1
SCHEMBL14981920 0.69 TSHR (0.49) POLBLMNANPSR1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170172855-A1 Compositions With Controlled Network Structure TECHNISCHE UNIVERSITÄT WIEN (AT) 2017-06-22 US disclosed
US-20170172855-A1 Compositions With Controlled Network Structure TECHNISCHE UNIVERSITÄT WIEN (AT) 2017-06-22 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-20170172855-A1 Compositions With Controlled Network Structure NCLN, RAD51, SMCHD1 POLB 429/4885LMNA 260/4885NPSR1 4579/4885

“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.