SCHEMBL27730142

SCHEMBL27730142

Cc1cccc(Nc2ccccc2)c1Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.46
▸ MAPT P10636 5/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ GLA P06280 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ SIRT2 Q8IXJ6 1/20 0.42
▸ SIRT1 Q96EB6 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ TSHR P16473 3/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CDC25B P30305 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ LMNA P02545 1/20 0.40

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
SCHEMBL24080772 0.81 HPGD (0.42) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL9487846 0.79 LTA4H (0.52) MAPTKMT2AKDM4EGLATSHR
SCHEMBL28294431 0.76 ALDH1A1 (0.59) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL22339032 0.76 TAS2R38 (0.42) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL304152 0.75 MAPT (0.56) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL11166000 0.74 ALDH1A1 (0.45) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL11161033 0.74 ADRA2A (0.66) —
SCHEMBL30594032 0.74 MEN1 (0.58) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL429858 0.74 MEN1 (0.58) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL15966366 0.72 TSHR (0.51) GAAMAPTMEN1KMT2AKDM4E

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-101222849-A Synergistic fungicidal compositions ISAGRO SPA (IT) 2008-07-16 — — CN claimed
CN-101222849-A Synergistic fungicidal compositions ISAGRO SPA (IT) 2008-07-16 — — CN disclosed
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