SCHEMBL3776958

SCHEMBL3776958

Cc1nc2c(Cl)ccc(OCC(=O)O)c2c(OC(C)C)c1Cc1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.45
PPARD Q03181 6/20 0.39
FFAR1 O14842 1/20 0.39
LMNA P02545 1/20 0.39
PLA2G2A P14555 1/20 0.37
PTGDR Q13258 1/20 0.36
P2RX3 P56373 4/20 0.36
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
TRPC5 Q9UL62 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
PKM P14618 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
SCHEMBL3778911 0.93 PTGDR2 (0.53) PTGDR2PPARDFFAR1PLA2G2ATHRA
SCHEMBL3779205 0.91 ALDH1A1 (0.38) PTGDR2LMNAPLA2G2AP2RX3TRPC5
SCHEMBL3772870 0.86 PTGDR2 (0.51) PTGDR2PPARDP2RX3TSHRTDP1
SCHEMBL3781764 0.85 PTGDR2 (0.40) PTGDR2PPARDFFAR1PLA2G2APTGDR
SCHEMBL3771722 0.84 PTGDR2 (0.44) PTGDR2LMNAPLA2G2A
SCHEMBL3777201 0.82 PTGDR2 (0.46) PTGDR2PTGDR
SCHEMBL3778460 0.82 PTGDR2 (0.66) PTGDR2PPARDFFAR1PLA2G2ATHRA
SCHEMBL3782152 0.82 TDP1 (0.43) PTGDR2PPARDPLA2G2ATSHRTDP1
SCHEMBL3772687 0.80 PTGDR2 (0.59) PTGDR2PPARDFFAR1P2RX3TSHR
SCHEMBL3779640 0.80 PTGDR2 (0.45) PTGDR2PPARDFFAR1PLA2G2APTGDR

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 10 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-7858640-B2 Quinolines and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-12-28 US 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
US-20090156600-A1 Quinolines and Their Therapeutic Use GB005, INC. 2009-06-18 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
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 PTGDR2 146/4885PPARD 779/4885FFAR1 96/4885

“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.