SCHEMBL8983603

SCHEMBL8983603

Cc1ccc(NC(=O)Oc2cccc(N(C)C(=O)O)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.66
ACHE P22303 1/20 0.66
ALDH1A1 P00352 5/20 0.56
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
MAPT P10636 2/20 0.56
KDM4E B2RXH2 2/20 0.56
THRB P10828 1/20 0.56
GFER P55789 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
FAAH O00519 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
MTNR1A P48039 2/20 0.48
MTNR1B P49286 2/20 0.48
TP53 P04637 2/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
HSD17B1 P14061 1/20 0.45
HSD17B2 P37059 1/20 0.45

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
SCHEMBL8419739 0.89 ALDH1A1 (0.66) BCHEACHEALDH1A1KMT2AMEN1
SCHEMBL10675015 0.89 BCHE (0.64) BCHEACHEALDH1A1KMT2AMEN1
SCHEMBL10670226 0.84 BCHE (0.58) BCHEACHEALDH1A1KMT2AMEN1
SCHEMBL10666880 0.81 BCHE (0.55) BCHEACHEALDH1A1KMT2AMEN1
SCHEMBL11663128 0.81 BCHE (0.55) BCHEACHEALDH1A1KMT2AMEN1
SCHEMBL8983609 0.81 KMT2A (0.64) BCHEACHEALDH1A1KMT2AMEN1
Desmedipham SCHEMBL10855785 0.79 BCHE (0.58) BCHEACHEALDH1A1KMT2AMEN1
SCHEMBL6037499 0.79 ALDH1A1 (0.75) ALDH1A1KMT2AMEN1MAPTKDM4E
Hydrochloric Acid SCHEMBL29406709 0.79 BCHE (0.97) BCHEACHEALDH1A1KMT2AMEN1
SCHEMBL11600239 0.77 MAPK1 (0.50) BCHEACHEALDH1A1KMT2AMEN1

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
EP-0637910-B1 STABILIZED HERBICIDE COMPOSITIONS KVK AGRO AS (DK) 1996-06-05 EP disclosed
EP-0637910-A1 STABILIZED HERBICIDE COMPOSITIONS. KVK AGRO AS (DK) 1995-02-15 EP disclosed