SCHEMBL13047045

SCHEMBL13047045

Cc1ccc(Oc2ccc(OCc3ccccc3)c(Cl)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 7/20 0.52
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
FFAR1 O14842 2/20 0.46
MAPT P10636 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
FFAR4 Q5NUL3 1/20 0.44
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL13047783 0.89 FFAR1 (0.46) MRGPRX4RAB9ANPC1NFKB1NFKB2
SCHEMBL9445027 0.87 HTR2A (0.52) MRGPRX4RAB9ANPC1SMN1; SMN2FFAR1
SCHEMBL130824 0.85 MRGPRX4 (0.68) MRGPRX4RAB9ANPC1NFKB1NFKB2
SCHEMBL2395569 0.84 NPC1 (0.48) MRGPRX4RAB9ANPC1NFKB1NFKB2
SCHEMBL17658995 0.83 ALOX5 (0.58) MRGPRX4RAB9ANPC1NFKB1NFKB2
SCHEMBL9445005 0.82 PPARA (0.44) MRGPRX4PPARGHTR2ASLC6A4KCNH2
SCHEMBL3758682 0.82 MAOB (0.61) MRGPRX4RAB9ANPC1NFKB1NFKB2
SCHEMBL2705229 0.82 MRGPRX4 (0.65) MRGPRX4RAB9ANPC1NFKB1NFKB2
SCHEMBL12734036 0.80 FFAR1 (0.46) RAB9ASMN1; SMN2FFAR1MAPTL3MBTL1
SCHEMBL8736979 0.80 LMNA (0.60) RAB9ASMN1; SMN2FFAR1MAPTL3MBTL1

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 2 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

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 MRGPRX4 8/4885RAB9A 2234/4885NPC1 1661/4885

“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.