SCHEMBL8072014

SCHEMBL8072014

Cn1nc(Cl)cc1C(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.56
TDP1 Q9NUW8 5/20 0.47
KMT2A Q03164 4/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
JMJD6 Q6NYC1 1/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 5/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
LMNA P02545 3/20 0.44
HTT P42858 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAOB P27338 1/20 0.44
ADORA2A P29274 1/20 0.44
MEN1 O00255 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
SCHEMBL21290253 0.84 JMJD6 (0.51) SMN1; SMN2TDP1KMT2ASLC6A2SLC6A3
SCHEMBL18760785 0.84 TDP1 (0.56) SMN1; SMN2TDP1KMT2ASLC6A2SLC6A3
SCHEMBL8072052 0.79 LMNA (0.56) SMN1; SMN2TDP1KMT2APOLBMAPT
SCHEMBL1267682 0.76 SMN1; SMN2 (0.57) SMN1; SMN2KMT2APOLBMEN1NPC1
SCHEMBL20646162 0.75 GPR52 (0.52) TDP1KMT2ASLC6A2SLC6A3JMJD6
SCHEMBL22005632 0.73 TDP1 (0.53) SMN1; SMN2TDP1KMT2ASLC6A2SLC6A3
SCHEMBL20154228 0.73 MAPT (0.57) SMN1; SMN2TDP1KMT2ASLC6A2SLC6A3
SCHEMBL9374743 0.73 TDP1 (0.66) SMN1; SMN2TDP1KMT2ASLC6A2SLC6A3
SCHEMBL26783213 0.73 TDP1 (0.56) SMN1; SMN2TDP1KMT2ASLC6A2SLC6A3
SCHEMBL20776996 0.72 TDP1 (0.51) SMN1; SMN2TDP1KMT2ASLC6A2SLC6A3

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-0757987-B1 Pyrazole-carboxylic acid derivatives as plant disease control agents NISSAN CHEMICAL IND LTD (JP) 2000-07-19 EP disclosed
US-5817829-A FUNGICIDES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-06 US disclosed
EP-0757987-A1 PYRAZOLECARBOXYLIC ACID DERIVATIVE AND PLANT DISEASE CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1997-02-12 EP disclosed