SCHEMBL28402137

SCHEMBL28402137

Cc1ccc2c(=O)c3ccc4ccccc4c3oc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.55
▸ ABCG2 Q9UNQ0 5/20 0.47
▸ ABCC1 P33527 4/20 0.47
▸ MAOA P21397 5/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ HPGD P15428 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ ABCB1 P08183 2/20 0.46
▸ CYP1A1 P04798 2/20 0.46
▸ CYP1B1 Q16678 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ PDE5A O76074 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP19A1 P11511 1/20 0.46

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
SCHEMBL28396374 0.90 KMT2A (0.54) KMT2AABCG2ABCC1MAOAKDM4E
SCHEMBL10109866 0.87 KMT2A (0.53) KMT2AABCG2ABCC1MAOAKDM4E
SCHEMBL12764548 0.84 MAOA (0.61) KMT2AABCG2ABCC1MAOAKDM4E
SCHEMBL13562231 0.83 KMT2A (0.47) KMT2AABCG2ABCC1MAOAKDM4E
SCHEMBL22337130 0.82 KMT2A (0.48) KMT2AABCG2ABCC1MAOAKDM4E
SCHEMBL13712773 0.81 MAOA (0.51) MAOAKDM4EHPGDALDH1A1MAPT
SCHEMBL2628169 0.80 MAOA (0.67) KMT2AMAOAKDM4EHPGDALDH1A1
SCHEMBL15030783 0.80 ABCG2 (0.60) KMT2AABCG2ABCC1KDM4EHPGD
SCHEMBL10109872 0.80 KMT2A (0.51) KMT2AABCG2ABCC1MAOAKDM4E
SCHEMBL19662669 0.79 MAOA (0.49) KMT2AMAOAKDM4EHPGDALDH1A1

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
CN-111057037-B Ultraviolet light-promoted synthesis method of xanthone compound 浙江工业大学 2021-07-23 — — CN disclosed
CN-111057037-A Ultraviolet light-promoted synthesis method of xanthone compound 浙江工业大学 2020-04-24 — — CN disclosed
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