SCHEMBL2705286

SCHEMBL2705286

O=C(OOc1ccc(O)nn1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.52
▸ F2 P00734 1/20 0.52
▸ TDP1 Q9NUW8 5/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ TSHR P16473 3/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ KMT2A Q03164 6/20 0.37
▸ MAPT P10636 5/20 0.37
▸ TP53 P04637 1/20 0.37
▸ PARP10 Q53GL7 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ L3MBTL1 Q9Y468 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
SCHEMBL2707585 0.75 LMNA (0.50) LMNAF2TDP1ALDH1A1TSHR
SCHEMBL14877345 0.75 LMNA (0.59) LMNAF2TDP1ALDH1A1TSHR
Benzoyl Peroxide SCHEMBL2929886 0.71 LMNA (1.00) LMNAF2TDP1ALDH1A1TSHR
Benzoyl Peroxide SCHEMBL63 0.71 LMNA (1.00) LMNAF2TDP1ALDH1A1TSHR
Benzoyl Peroxide SCHEMBL3467853 0.71 LMNA (1.00) LMNAF2TDP1ALDH1A1TSHR
Benzoyl Peroxide SCHEMBL5312311 0.71 LMNA (1.00) LMNAF2TDP1ALDH1A1TSHR
Benzoyl Peroxide SCHEMBL9407293 0.71 LMNA (1.00) LMNAF2TDP1ALDH1A1TSHR
SCHEMBL10560176 0.70 F2 (0.70) LMNAF2TDP1ALDH1A1TSHR
SCHEMBL29611759 0.70 LMNA (0.70) LMNAF2TDP1ALDH1A1TSHR
SCHEMBL5244678 0.70 F2 (0.70) LMNAF2TDP1ALDH1A1TSHR

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
EP-2435462-A1 NOVEL GLUCOCORTICOID RECEPTOR AGONISTS Pfizer Limited (GB) 2012-04-04 — — EP disclosed
WO-2010136940-A1 NOVEL GLUCOCORTICOID RECEPTOR AGONISTS PFIZER LIMITED (GB) 2010-12-02 — — WO disclosed
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