SCHEMBL3759614

SCHEMBL3759614

O=C(O)c1ccc(Oc2ccc(OCc3ccccc3)nc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.63
NR4A1 P22736 1/20 0.63
NR4A3 Q92570 1/20 0.63
SRD5A2 P31213 4/20 0.58
ACACB O00763 2/20 0.58
ACACA Q13085 1/20 0.58
PLA2G4B P0C869 1/20 0.56
P4HTM Q9NXG6 1/20 0.54
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CXCR2 P25025 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.49
OPRM1 P35372 1/20 0.49
OPRD1 P41143 1/20 0.49
OPRK1 P41145 1/20 0.49
MAOB P27338 1/20 0.49
PARP10 Q53GL7 1/20 0.49
ALKBH1 Q13686 1/20 0.48

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
SCHEMBL1221922 0.85 MAPT (0.63) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL1221359 0.84 NR4A2 (0.90) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL6339254 0.83 NR4A2 (0.68) NR4A2NR4A1NR4A3SRD5A2ACACB
SCHEMBL6030735 0.83 MAP4K4 (0.62) NR4A2NR4A1NR4A3SRD5A2ACACB
SCHEMBL13047644 0.81 ACACB (0.56) ACACBACACAP4HTMMEN1KMT2A
SCHEMBL1547599 0.81 ACACB (0.53) ACACBACACAP4HTMMRGPRX4MAOB
Nitrous Acid SCHEMBL27888273 0.80 MAPT (0.56) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL6830467 0.78 NR4A2 (1.00) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL228477 0.78 NR4A2 (1.00) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL4059143 0.78 NR4A2 (1.00) NR4A2NR4A1NR4A3SRD5A2PLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010136940-A1 NOVEL GLUCOCORTICOID RECEPTOR AGONISTS PFIZER LIMITED (GB) 2010-12-02 WO disclosed
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 US disclosed
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 US disclosed
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 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 (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-20100303758-A1 Novel Glucocorticoid Receptor Agonists NR3C1, NR3C2, MC2R NR4A2 129/4885NR4A1 114/4885NR4A3 153/4885

“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.