SCHEMBL699298

SCHEMBL699298

NC(=O)c1cccc(NC(=O)OCCCl)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.58
RAB9A P51151 4/20 0.56
LMNA P02545 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SMN1; SMN2 Q16637 5/20 0.52
NPC1 O15118 3/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
ALDH1A1 P00352 1/20 0.50
MAPK1 P28482 1/20 0.50
PARP1 P09874 11/20 0.49
PARP10 Q53GL7 10/20 0.49
PARP15 Q460N3 5/20 0.49
PARP14 Q460N5 4/20 0.49

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
SCHEMBL8490672 0.91 HPGD (0.64) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL832082 0.87 RAB9A (0.64) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL29687812 0.87 RAB9A (0.64) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL698170 0.87 HPGD (0.59) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL20169847 0.82 SMN1; SMN2 (0.65) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL882828 0.81 RAB9A (0.72) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL1412559 0.81 MEN1 (0.68) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL30633435 0.81 MEN1 (0.68) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL20177092 0.79 GAA (0.53) HPGDRAB9ALMNAMEN1KMT2A
SCHEMBL9202177 0.79 HPGD (0.57) HPGDRAB9ALMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423188-B1 Intermediates in the preparation of agricultural/horticultural insecticides and method for using the same MITSUI CHEMICALS AGRO INC (JP) 2021-03-10 EP disclosed
EP-1661886-B1 INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF MITSUI CHEMICALS AGRO INC (JP) 2016-08-10 EP disclosed
EP-2423188-A1 Agricultural/Horticultural Insecticide and Method for Using the Same MITSUI CHEMICALS AGRO, INC. (JP) 2012-02-29 EP disclosed
EP-1661886-A1 INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF Mitsui Chemicals, Inc. (JP) 2006-05-31 EP disclosed