SCHEMBL7199048

SCHEMBL7199048

O=c1ccccn1CC=CO

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TSHR P16473 1/20 0.41
PSMB1 P20618 2/20 0.40
PSMB5 P28074 2/20 0.38
PREP P48147 1/20 0.38
FAP Q12884 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 1/20 0.36
MITF O75030 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
AOC2 O75106 1/20 0.33
KLKB1 P03952 1/20 0.31
KLK1 P06870 1/20 0.31

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
SCHEMBL9752611 0.88 POLB (0.48) POLBNPSR1TSHRPSMB1PSMB5
SCHEMBL9752610 0.88 POLB (0.48) POLBNPSR1TSHRPSMB1PSMB5
SCHEMBL9752638 0.88 POLB (0.48) POLBNPSR1TSHRPSMB1PSMB5
SCHEMBL9752569 0.79 POLB (0.42) POLBNPSR1TSHRPSMB1PSMB5
SCHEMBL9752567 0.79 POLB (0.42) POLBNPSR1TSHRPSMB1PSMB5
SCHEMBL28003655 0.78 ALDH1A1 (0.46) NPSR1TSHRLMNASMN1; SMN2
SCHEMBL28003654 0.78 ALDH1A1 (0.46) NPSR1TSHRLMNASMN1; SMN2
SCHEMBL4122303 0.78 POLB (0.47) POLBNPSR1TSHRPSMB1PSMB5
SCHEMBL1381419 0.76 POLB (0.46) POLBNPSR1TSHRPSMB1L3MBTL1
SCHEMBL30874636 0.76 POLB (0.42) POLBNPSR1TSHRPSMB1PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6639093-B2 Reacting benzyl chloride with hydroxybenzoic acid BAYER AKTIENGESELLSCHAFT (DE) 2003-10-28 US disclosed
US-20030053964-A1 Process for the preparation of hydroxybenzoic benzyl esters BAYER AKTIENGESELLSCHAFT (DE) 2003-03-20 US disclosed
EP-1249443-A2 Process for the production of hydroxybenzoic acid benzyl esters BAYER AG (DE) 2002-10-16 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 (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-20030053964-A1 Process for the preparation of hydroxybenzoic benzyl esters HAAO, HPD, HACL2 POLB 504/4885NPSR1 3509/4885TSHR 3829/4885

“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.