SCHEMBL6933671

SCHEMBL6933671

CCCc1ccccc1NC(=O)C=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.45
TAS1R1 Q7RTX1 1/20 0.45
CYSLTR2 Q9NS75 1/20 0.45
CYSLTR1 Q9Y271 1/20 0.45
PLA2G7 Q13093 1/20 0.44
MAPT P10636 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HTT P42858 3/20 0.43
LMNA P02545 3/20 0.43
PKM P14618 2/20 0.43
NLRP1 Q9C000 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43

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
SCHEMBL8980104 0.87 MAPT (0.54) POLBTAS1R3TAS1R1MAPTALDH1A1
SCHEMBL15093807 0.84 POLB (0.58) POLBTAS1R3TAS1R1MAPTALDH1A1
SCHEMBL29580855 0.84 POLB (0.58) POLBTAS1R3TAS1R1MAPTALDH1A1
SCHEMBL2022897 0.82 POLB (0.53) POLBTAS1R3TAS1R1MAPTALDH1A1
SCHEMBL1644885 0.82 MAPK1 (0.59) POLBTAS1R3TAS1R1MAPTALDH1A1
SCHEMBL29581095 0.82 GRIN2D (0.49) POLBTAS1R3TAS1R1PLA2G7MAPT
SCHEMBL1953147 0.82 GRIN2D (0.49) POLBTAS1R3TAS1R1PLA2G7MAPT
SCHEMBL5541881 0.81 POLB (0.47) POLBTAS1R3TAS1R1PLA2G7MAPT
SCHEMBL15706900 0.81 HDAC3 (0.51) POLBTAS1R3TAS1R1MAPTALDH1A1
SCHEMBL28954435 0.79 POLB (0.46) POLBTAS1R3TAS1R1MAPTALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200393-B1 OXIME AMIDES AND HYDRAZONE AMIDES HAVING FUNGICIDAL ACTIVITY MONSANTO TECHNOLOGY LLC (US) 2003-12-10 EP disclosed
EP-1200393-A1 OXIME AMIDES AND HYDRAZONE AMIDES HAVING FUNGICIDAL ACTIVITY Monsanto Technology LLC (US) 2002-05-02 EP disclosed
WO-2001012590-A1 OXYME AMIDES AND HYDRAZONE AMIDES HAVING FUNGICIDAL ACTIVITY MONSANTO TECHNOLOGY LLC (US) 2001-02-22 WO disclosed