SCHEMBL3779263

SCHEMBL3779263

CC(=O)C(Cc1ccc(S(C)(=O)=O)cc1)C(=O)Nc1cc(O)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
LNPEP Q9UIQ6 4/20 0.38
ERAP2 Q6P179 3/20 0.38
CASR P41180 1/20 0.37
ENPP2 Q13822 1/20 0.37
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
EPHX2 P34913 2/20 0.35
PTGS2 P35354 2/20 0.35
GAA P10253 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL3783304 0.90 KIF11 (0.41) ALDH1A1LMNATSHRLNPEPERAP2
SCHEMBL3784633 0.87 GAA (0.42) ALDH1A1LMNALNPEPERAP2GAA
SCHEMBL3777270 0.87 ALDH1A1 (0.47) ALDH1A1LMNAGAAMEN1NPC1
SCHEMBL3785370 0.86 MDM2 (0.42) ALDH1A1LNPEPERAP2MEN1KMT2A
SCHEMBL2577121 0.85 LNPEP (0.39) ALDH1A1LMNALNPEPERAP2GAA
SCHEMBL3787305 0.84 PDK1 (0.40) ALDH1A1LMNATSHRCASRCA1
SCHEMBL534032 0.82 GPR142 (0.39) LNPEPERAP2
SCHEMBL2581345 0.81 LNPEP (0.41) ALDH1A1LNPEPERAP2ESR1ESR2
SCHEMBL2573357 0.77 TNIK (0.41)
SCHEMBL3778904 0.76 MAPT (0.43) ALDH1A1GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928457-B1 QUINOLINES AND THEIR THERAPEUTIC USE PULMAGEN THERAPEUTICS ASTHMA LTD (GB) 2012-12-12 EP disclosed
US-7858640-B2 Quinolines and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-12-28 US disclosed
US-20090156600-A1 Quinolines and Their Therapeutic Use GB005, INC. 2009-06-18 US disclosed
EP-1928457-A2 QUINOLINES AND THEIR THERAPEUTIC USE Argenta Discovery Limited (GB) 2008-06-11 EP disclosed
WO-2007036743-A2 QUINOLINES AND THEIR THERAPEUTIC USE ARGENTA DISCOVERY LIMITED (GB) 2007-04-05 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-20090156600-A1 Quinolines and Their Therapeutic Use NR3C1, NR3C2, NR1H3 ALDH1A1 4201/4885LMNA 3732/4885TSHR 73/4885

“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.