SCHEMBL27737511

SCHEMBL27737511

C=C(C)C(=O)Oc1ccc2ccccc2c1.O=C1C=CC(=O)N1c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.50
▸ ATM Q13315 2/20 0.50
▸ HSP90AA1 P07900 2/20 0.49
▸ ELANE P08246 1/20 0.47
▸ MGLL Q99685 6/20 0.45
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ PTGS1 P23219 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ FAAH O00519 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ MMP12 P39900 1/20 0.38
▸ PTPN7 P35236 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL13133152 0.84 MGLL (0.58) KMT2AATMHSP90AA1ELANEMGLL
SCHEMBL29801955 0.84 ELANE (0.58) KMT2AATMELANEMAPTMEN1
SCHEMBL36603 0.84 ELANE (0.58) KMT2AATMELANEMAPTMEN1
SCHEMBL31476932 0.84 ELANE (0.58) KMT2AATMELANEMAPTMEN1
SCHEMBL13133153 0.82 KMT2A (0.70) KMT2AATMHSP90AA1ELANEMGLL
SCHEMBL17451248 0.80 ELANE (0.58) KMT2AELANEMAPTMEN1TDP1
SCHEMBL11746613 0.79 ELANE (0.57) KMT2AATMELANEMAPTMEN1
SCHEMBL3746217 0.78 MGLL (0.56) KMT2AATMHSP90AA1MGLLMAPT
SCHEMBL2121980 0.78 ELANE (0.53) KMT2AATMELANEMAPTMEN1
SCHEMBL803231 0.78 ELANE (0.56) KMT2AATMELANEMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101395225-A Radiation curable system GARNETT JOHN LYNDON (AU) 2009-03-25 — — CN disclosed
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