SCHEMBL3778740

SCHEMBL3778740

CCc1[nH]c2c(F)ccc(OCC(=O)OC)c2c(=O)c1Cc1ccc(C(=O)N2CCCC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 10/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.36
PARP1 P09874 3/20 0.36
HSD17B10 Q99714 2/20 0.36
NPY4R P50391 2/20 0.36
ATM Q13315 1/20 0.35
ALDH1A1 P00352 5/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL3776986 0.90 HPGD (0.41) HPGDL3MBTL1KDM4EPARP1HSD17B10
SCHEMBL534053 0.88 MAOB (0.34) KDM4EALDH1A1KMT2AMAPT
SCHEMBL3780979 0.87 HPGD (0.40) HPGDL3MBTL1HSD17B10NPY4R
SCHEMBL3779461 0.87 ALDH1A1 (0.41) HPGDL3MBTL1KDM4EALDH1A1KMT2A
SCHEMBL3779428 0.86 PTGDR2 (0.36) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL2575631 0.85 ERAP1 (0.35) HPGDKDM4EALDH1A1MEN1KMT2A
SCHEMBL2573624 0.85 ALDH1A1 (0.34) HPGDKDM4EATMALDH1A1MEN1
SCHEMBL3776184 0.83 TSHR (0.36) HPGDL3MBTL1KDM4EALDH1A1SMN1; SMN2
SCHEMBL3779431 0.83 PTGDR2 (0.37) HPGDL3MBTL1KDM4EALDH1A1SMN1; SMN2
SCHEMBL2570634 0.82 PDE2A (0.38) MEN1KMT2ASMN1; 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 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 HPGD 1772/4885L3MBTL1 3442/4885KDM4E 4638/4885

“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.