SCHEMBL22946403

SCHEMBL22946403

C[C@@H](Oc1nc(F)c(Cl)c(N)c1Cl)C(=O)OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 3/20 0.39
ELANE P08246 1/20 0.37
ATM Q13315 1/20 0.36
PLAU P00749 3/20 0.35
POLB P06746 1/20 0.35
MAP3K5 Q99683 1/20 0.35
PLG P00747 1/20 0.35
SLC15A1 P46059 1/20 0.34

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
SCHEMBL22182561 1.00 LMNA (0.41) LMNAL3MBTL1ALDH1A1ELANEATM
SCHEMBL22946402 0.86 ALDH1A1 (0.38) LMNAL3MBTL1ALDH1A1
SCHEMBL22946854 0.85 ALDH1A1 (0.39) LMNAL3MBTL1ALDH1A1ELANEATM
SCHEMBL22182584 0.85 PGR (0.43) LMNAL3MBTL1ALDH1A1
SCHEMBL22182579 0.84 ALDH1A1 (0.36) L3MBTL1ALDH1A1ELANEPLAUPOLB
SCHEMBL22946858 0.84 TDP1 (0.39) LMNAL3MBTL1ALDH1A1ELANEATM
SCHEMBL22946571 0.84 ALDH1A1 (0.46) LMNAALDH1A1POLB
SCHEMBL22946838 0.82 IDO1 (0.34) L3MBTL1ALDH1A1ELANEPLAUPOLB
SCHEMBL23967687 0.82 KMT2A (0.34) LMNAL3MBTL1ALDH1A1ATMPOLB
SCHEMBL22170066 0.82 KMT2A (0.34) LMNAL3MBTL1ALDH1A1ATMPOLB

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-4005384-A1 HERBICIDAL COMPOSITION CONTAINING R-TYPE PYRIDYLOXY CARBOXYLIC ACID DERIVATIVE AND USE THEREOF Qingdao KingAgroot Chemical Compound Co., Ltd. (CN) 2022-06-01 EP disclosed
WO-2021036251-A1 HERBICIDAL COMPOSITION CONTAINING R-TYPE PYRIDYLOXY CARBOXYLIC ACID DERIVATIVES AND APPLICATION THEREOF 青岛清原化合物有限公司 2021-03-04 WO disclosed
WO-2021017502-A1 HERBICIDAL COMPOSITION CONTAINING R-TYPE PYRIDYLOXY CARBOXYLIC ACID DERIVATIVE AND USE THEREOF 青岛清原化合物有限公司 2021-02-04 WO disclosed
WO-2021017817-A1 HERBICIDAL COMPOSITION CONTAINING R-TYPE PYRIDYLOXY CARBOXYLIC ACID DERIVATIVE AND USE THEREOF 青岛清原化合物有限公司 2021-02-04 WO disclosed