SCHEMBL8349883

SCHEMBL8349883

CCNC(=O)c1ccccc1O.COc1cccc(CN[Mn])c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.54
▸ HPGD P15428 7/20 0.50
▸ ALDH1A1 P00352 6/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ RCE1 Q9Y256 1/20 0.46
▸ TP53 P04637 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ TAS1R3 Q7RTX0 1/20 0.44
▸ TAS1R1 Q7RTX1 1/20 0.44
▸ CA1 P00915 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ GAA P10253 3/20 0.42
▸ HTT P42858 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ EZH2 Q15910 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ GFER P55789 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL8347809 0.84 CA1 (0.52) ATMHPGDALDH1A1KDM4ECA1
SCHEMBL8349887 0.81 ATM (0.55) ATMHPGDALDH1A1KDM4ERCE1
SCHEMBL8346501 0.80 HPGD (0.49) ATMHPGDALDH1A1KDM4ETP53
SCHEMBL8345459 0.79 KMT2A (0.51) HPGDALDH1A1KDM4EKMT2AGAA
SCHEMBL1797745 0.75 CA1 (0.68) HPGDALDH1A1KDM4ETP53CA1
SCHEMBL8346284 0.74 CA1 (0.59) HPGDALDH1A1KDM4ETP53CA1
SCHEMBL4114974 0.74 CTSD (0.69) HPGDALDH1A1TP53GLAKMT2A
SCHEMBL8350227 0.73 ALOX5 (0.50) HPGDALDH1A1KDM4ECA1CA9
Isobutyramide SCHEMBL7723757 0.72 CA1 (0.56) HPGDALDH1A1KDM4ECA1CA9
Phosphoric Acid SCHEMBL8161708 0.72 NAAA (0.60) HPGDALDH1A1KDM4ECA1CA9

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-5969171-A Metal complexes as bleach activators CLARIANT GMBH (DE) 1999-10-19 — — US disclosed
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