SCHEMBL3777437

SCHEMBL3777437

COC(=O)COc1cccc2nc(C)c(Cc3ccc(Cl)cc3)cc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.47
KCNH2 Q12809 1/20 0.41
HTT P42858 3/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TRPM4 Q8TD43 1/20 0.40
KDM4E B2RXH2 3/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.38
PTGDR Q13258 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL3778473 0.90 PTGDR2 (0.45) PLA2G2AHTTMAPTSMN1; SMN2LMNA
SCHEMBL3778420 0.83 KDM4E (0.43) PLA2G2AMAPTSMN1; SMN2LMNATDP1
SCHEMBL11069880 0.75 PTGER1 (0.54) MAPTLMNATDP1KDM4EPTGDR
SCHEMBL3771025 0.74 TDP1 (0.48) HTTMAPTTDP1KDM4EPTGDR
SCHEMBL3777108 0.72 ALDH1A1 (0.44) PLA2G2AHTTSMN1; SMN2LMNAL3MBTL1
SCHEMBL3985579 0.72 LMNA (0.44) HTTMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL3777738 0.72 LMNA (0.42) LMNATDP1KDM4EPOLBMAPK1
SCHEMBL3989567 0.70 LMNA (0.41) HTTMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL3979381 0.70 LMNA (0.48) HTTMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL3779792 0.68 ALDH1A1 (0.44) PLA2G2AHTTSMN1; SMN2LMNAKDM4E

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 PLA2G2A 1779/4885KCNH2 867/4885HTT 3597/4885

“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.