SCHEMBL2571339

SCHEMBL2571339

COC(=O)COc1ccc(F)c2[nH]c(=O)c(Cc3ccc(-n4cccn4)cc3)c(C)c12

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.50
RORC P51449 7/20 0.37
CHRM1 P11229 4/20 0.37
JAK2 O60674 2/20 0.36
KDM4E B2RXH2 1/20 0.36
EGLN1 Q9GZT9 4/20 0.35
JAK3 P52333 1/20 0.34
GHSR Q92847 1/20 0.34
USP1 O94782 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
SCHEMBL2576335 0.90 PTGDR2 (0.43) PTGDR2RORCCHRM1JAK2EGLN1
SCHEMBL3778865 0.86 ALDH1A1 (0.43) JAK2KDM4E
SCHEMBL2572641 0.85 PTGDR2 (0.52) PTGDR2RORCCHRM1JAK2KDM4E
SCHEMBL2576364 0.85 PTGDR2 (0.50) PTGDR2RORCJAK2KDM4EEGLN1
SCHEMBL27801718 0.85 PTGDR2 (0.40) PTGDR2RORCCHRM1JAK2JAK3
SCHEMBL2570456 0.84 PTGDR2 (0.43) PTGDR2RORCCHRM1KDM4EEGLN1
SCHEMBL3345117 0.84 PTGDR2 (0.50) PTGDR2RORCCHRM1JAK2KDM4E
SCHEMBL3351461 0.83 ALDH1A1 (0.37) PTGDR2KDM4E
SCHEMBL2576178 0.82 PTGDR2 (0.41) PTGDR2RORCCHRM1KDM4E
SCHEMBL2575061 0.82 PTGDR2 (0.56) PTGDR2RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394830-B2 Quinolines and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2013-03-12 US disclosed
US-20120184579-A1 Quinolines and Their Therapeutic Use GB005, INC. 2012-07-19 US disclosed
US-8173812-B2 Quinolines and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2012-05-08 US disclosed
EP-2139881-B1 QUINOLINES AND THEIR THERAPEUTIC USE PULMAGEN THERAPEUTICS ASTHMA LTD (GB) 2011-11-09 EP disclosed
US-20100144787-A1 Quinolines and Their Therapeutic Use GB005, INC. 2010-06-10 US disclosed
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO disclosed
EP-2139881-A1 QUINOLINES AND THEIR THERAPEUTIC USE Argenta Oral Therapeutics Limited (GB) 2010-01-06 EP disclosed
WO-2008122784-A1 QUINOLINES AND THEIR THERAPEUTIC USE ARGENTA DISCOVERY LIMITED (GB) 2008-10-16 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 (2 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-20100144787-A1 Quinolines and Their Therapeutic Use CHRM3, CHRM2, HRH1 PTGDR2 301/4885RORC 111/4885CHRM1 5/4885
US-20120184579-A1 Quinolines and Their Therapeutic Use HRH1, CHRM2, CHRM3 PTGDR2 316/4885RORC 118/4885CHRM1 6/4885

“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.