SCHEMBL2573441

SCHEMBL2573441

CCc1[nH]c2c(Cl)ccc(OCC(=O)OC)c2c(=O)c1Cc1ccc(-n2cccn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.46
RORC P51449 9/20 0.36
GHSR Q92847 1/20 0.35
CHRM1 P11229 1/20 0.34
USP1 O94782 2/20 0.34
SCN9A Q15858 1/20 0.34
JAK2 O60674 2/20 0.34
EGLN1 Q9GZT9 1/20 0.34
JAK3 P52333 1/20 0.34
ADRA2B P18089 1/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
NR1H3 Q13133 1/20 0.34
NR1I3 Q14994 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
KDM4E B2RXH2 1/20 0.33
BRS3 P32247 1/20 0.33

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
SCHEMBL2572641 0.91 PTGDR2 (0.52) PTGDR2RORCGHSRCHRM1USP1
SCHEMBL2571350 0.88 PTGDR2 (0.43) PTGDR2RORCGHSRUSP1JAK2
SCHEMBL2576335 0.85 PTGDR2 (0.43) PTGDR2RORCGHSRCHRM1SCN9A
SCHEMBL3779072 0.85 LMNA (0.37) PTGDR2KDM4E
SCHEMBL534098 0.81 ALDH1A1 (0.34) KDM4E
SCHEMBL3777589 0.81 TSHR (0.40) PTGDR2KDM4E
SCHEMBL2570600 0.80 LMNA (0.33) KDM4E
SCHEMBL2571353 0.80 HPGD (0.34) PPARGKDM4E
SCHEMBL3776986 0.80 HPGD (0.41) KDM4E
SCHEMBL2576364 0.79 PTGDR2 (0.50) PTGDR2RORCUSP1JAK2EGLN1

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 7 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
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 111/4885GHSR 602/4885
US-20120184579-A1 Quinolines and Their Therapeutic Use HRH1, CHRM2, CHRM3 PTGDR2 316/4885RORC 118/4885GHSR 626/4885

“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.