SCHEMBL20764929

SCHEMBL20764929

CCCN1C(=O)C(=O)NC1=S

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.49
MAPT P10636 12/20 0.49
MEN1 O00255 10/20 0.49
KMT2A Q03164 10/20 0.49
NPSR1 Q6W5P4 3/20 0.49
KDM4E B2RXH2 3/20 0.48
MAPK1 P28482 2/20 0.48
PKM P14618 2/20 0.48
GAA P10253 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
IDE P14735 2/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
HTT P42858 1/20 0.40
TLR9 Q9NR96 1/20 0.40
RECQL P46063 4/20 0.39
POLB P06746 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
HPGD P15428 2/20 0.39

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
SCHEMBL11477209 0.88 MEN1 (0.49) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL11771044 0.83 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL2728584 0.80 KMT2A (0.44) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL20151661 0.71 MEN1 (0.53) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL16278912 0.69 F2 (0.40) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL11499124 0.68 MGLL (0.50) ALDH1A1MAPTNPSR1KDM4ESMN1; SMN2
SCHEMBL2728279 0.68 HPGD (0.49) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL1100548 0.68 MAPT (0.39) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL11499891 0.67 MGLL (0.48) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL6231219 0.66 KMT2A (0.47) ALDH1A1MAPTMEN1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4240726-A1 [(1-PHENYL-5-(HETEROARYL)-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS Bayer Aktiengesellschaft (DE) 2023-09-13 EP disclosed
CN-114158553-B Novel pesticide preparation and preparation method thereof 南开沧州渤海新区绿色化工研究有限公司 2023-02-21 CN disclosed
CN-115397242-A Compound combinations having excellent herbicidal activity 拜耳公司 2022-11-25 CN disclosed
WO-2022096446-A1 [(1-PHENYL-5-(HETEROARYL)-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-05-12 WO disclosed
CN-114158553-A Novel pesticide preparation and preparation method thereof 南开沧州渤海新区绿色化工研究有限公司 2022-03-11 CN disclosed
WO-2019038102-A1 HERBICIDAL COMPOSITION LAMBERTI SPA (IT) 2019-02-28 WO disclosed