SCHEMBL14213384

SCHEMBL14213384

C=C1c2c(ccc(O)c2O)C(=O)c2c(O)ccc(C)c21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.61
▸ KMT2A Q03164 8/20 0.61
▸ MAPT P10636 8/20 0.61
▸ ALDH1A1 P00352 6/20 0.61
▸ MAPK1 P28482 6/20 0.61
▸ MAOA P21397 5/20 0.61
▸ KDM4E B2RXH2 5/20 0.61
▸ HPGD P15428 4/20 0.61
▸ CYP3A4 P08684 4/20 0.61
▸ RECQL P46063 4/20 0.61
▸ TDP1 Q9NUW8 4/20 0.61
▸ ALOX15 P16050 3/20 0.61
▸ HSD17B10 Q99714 3/20 0.61
▸ APEX1 P27695 3/20 0.61
▸ THRB P10828 3/20 0.61
▸ USP2 O75604 3/20 0.61
▸ CSNK2A2 P19784 3/20 0.61
▸ CSNK2B P67870 3/20 0.61
▸ CSNK2A1 P68400 3/20 0.61
▸ CSNK2A3 Q8NEV1 3/20 0.61

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
SCHEMBL17689250 0.85 MEN1 (0.79) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL13646440 0.80 MEN1 (0.66) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL30432375 0.79 ELANE (0.70) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL10909836 0.79 ELANE (0.70) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL29359549 0.79 ELANE (0.70) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL14680732 0.78 ELANE (0.72) MEN1KMT2AMAPTALDH1A1MAPK1
Quinalizarin SCHEMBL29516323 0.77 MAOA (1.00) MEN1KMT2AMAPTALDH1A1MAPK1
Quinalizarin SCHEMBL20608650 0.77 MAOA (1.00) MEN1KMT2AMAPTALDH1A1MAPK1
Quinalizarin SCHEMBL29437816 0.77 MAOA (1.00) MEN1KMT2AMAPTALDH1A1MAPK1
Quinalizarin SCHEMBL138122 0.77 MAOA (1.00) MEN1KMT2AMAPTALDH1A1MAPK1

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
US-20080119517-A1 COMPOSITIONS AND METHODS FOR PROTECTING AGAINST MITOCHONDRIA COMPONENT-MEDIATED PATHOLOGY CORNELL RESEARCH FOUNDATION, INC. (US) 2008-05-22 — — US disclosed
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