SCHEMBL28632597

SCHEMBL28632597

CN(CCOS(C)(=O)=O)S(=O)(=O)CC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MMP9 P14780 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.32
MMP3 P08254 3/20 0.32

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
SCHEMBL22345276 0.83 TSHR (0.36) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL28637720 0.76 POLB (0.36) POLBMMP3
SCHEMBL28632556 0.75 POLB (0.39) KDM4EALDH1A1POLBMMP3
SCHEMBL795481 0.74 USP2 (0.50) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL17264261 0.71 TSHR (0.43) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL14497716 0.69 USP2 (0.55) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL2077476 0.69 TSHR (0.55) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL28628306 0.69 LMNA (0.40) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL27006824 0.68 ALDH1A1 (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL28628057 0.68 KDM4E (0.39) KDM4EUSP2ALDH1A1LMNAMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113439081-A Pyridazinium compounds for use in methods of controlling unwanted plant growth 先正达农作物保护股份公司 2021-09-24 CN disclosed