SCHEMBL2763392

SCHEMBL2763392

O=Cc1ccccc1OC(=O)CCCCCBr

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 2/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.43
KDM4E B2RXH2 1/20 0.43
RECQL P46063 1/20 0.43
PTGS2 P35354 2/20 0.43
SRC P12931 2/20 0.42
LMNA P02545 3/20 0.41
GAA P10253 1/20 0.41
POLM Q9NP87 2/20 0.40
POLK Q9UBT6 2/20 0.40
POLL Q9UGP5 2/20 0.40
POLH Q9Y253 2/20 0.40
RAD52 P43351 1/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38

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
SCHEMBL2763300 0.98 PTGDR2 (0.49) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL2762750 0.94 ALDH1A1 (0.50) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL4644325 0.86 PTGDR2 (0.49) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL4644068 0.84 ALDH1A1 (0.51) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL7285448 0.84 KMT2A (0.57) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL4643449 0.84 ALDH1A1 (0.50) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL20143639 0.83 KMT2A (0.63) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL4642017 0.83 PTGDR2 (0.49) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL4642152 0.83 ALDH1A1 (0.53) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL18803118 0.82 KDM4E (0.67) PTGDR2ALDH1A1HPGDHTTSMN1; SMN2

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-1951653-B1 SALICYLIC ACID DERIVATIVES NICOX SA (FR) 2010-10-20 EP disclosed
US-20080293781-A1 Salicylic Acid Derivatives NICOX S.A. (FR) 2008-11-27 US disclosed
EP-1951653-A1 SALICYLIC ACID DERIVATIVES NicOx S.A. (FR) 2008-08-06 EP disclosed
WO-2007060112-A1 SALICYLIC ACID DERIVATIVES NICOX S.A. (FR) 2007-05-31 WO 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-20080293781-A1 Salicylic Acid Derivatives PTGS2, PTGS1, PTGES2 PTGDR2 98/4885ALDH1A1 51/4885HPGD 27/4885

“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.