SCHEMBL3843394

SCHEMBL3843394

O=C(O)c1cccc(CO)c1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.55
MAPT P10636 2/20 0.49
KDM4E B2RXH2 1/20 0.49
PIM1 P11309 1/20 0.49
GFER P55789 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 3/20 0.46
ALOX15 P16050 1/20 0.46
FOLH1 Q04609 2/20 0.46
PDCD1 Q15116 1/20 0.46
CD274 Q9NZQ7 1/20 0.46
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
LMNA P02545 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
FABP4 P15090 4/20 0.44
FABP3 P05413 2/20 0.44

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
SCHEMBL29254314 0.85 CLCN2 (0.54) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL6782256 0.84 HNF4A (0.49) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL1931921 0.84 DCLRE1B (0.56) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL70098 0.82 HNF4A (0.63) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL374696 0.80 FOLH1 (0.61) MAPTKDM4EALDH1A1ALOX15FOLH1
SCHEMBL8653763 0.80 FOLH1 (0.45) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL30209232 0.79 WDR5 (0.44) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL225203 0.79 HNF4A (0.71) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL28391136 0.78 HNF4A (0.59) HNF4AMAPTKDM4EPIM1GFER
SCHEMBL8768476 0.78 FOLH1 (0.59) MAPTKDM4EALDH1A1ALOX15FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7906684-B2 Antioxidants MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-03-15 US disclosed
US-7622612-B2 Tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2009-11-24 US disclosed
US-7622612-B2 Tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2009-11-24 US disclosed
US-20090246158-A1 ANTIOXIDANTS MERCK PATENT GESELLSCHAFT (DE) 2009-10-01 US disclosed
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 US disclosed
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 US 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-20090246158-A1 ANTIOXIDANTS LPO, GPX1, GPX4 HNF4A 3956/4885MAPT 1568/4885KDM4E 4182/4885
US-20070021427-A1 Novel tricyclic derivatives and their use NFATC1, IL2, CCL2 HNF4A 2449/4885MAPT 392/4885KDM4E 3815/4885

“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.