SCHEMBL8664448

SCHEMBL8664448

NC(=O)OCCS(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
PAX8 Q06710 1/20 0.47
HSD11B1 P28845 2/20 0.45
F2 P00734 3/20 0.44
PRSS1 P07477 3/20 0.44
PRSS2 P07478 3/20 0.44
PRSS3 P35030 3/20 0.44
ALDH1A1 P00352 1/20 0.43
POLB P06746 2/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL28624762 0.85 KMT2A (0.49) KMT2APAX8ALDH1A1LMNANPC1
SCHEMBL28621564 0.85 GAA (0.47) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL8662612 0.83 NPC1 (0.57) KMT2AHSD11B1F2PRSS1PRSS2
SCHEMBL114044 0.83 ALDH1A1 (0.57) KMT2APAX8F2PRSS1PRSS2
SCHEMBL787249 0.83 LMNA (0.54) HSD11B1LMNACA2
SCHEMBL1282212 0.83 MMP1 (0.55) KMT2AHSD11B1CA2
SCHEMBL24334708 0.81 HTT (0.60) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL1283002 0.80 F2 (0.48) KMT2AHSD11B1F2PRSS1PRSS2
SCHEMBL21590247 0.74 PLCG1 (0.46) KMT2AHSD11B1F2PRSS1PRSS2
SCHEMBL20503341 0.73 LMNA (0.60) HSD11B1LMNACA2

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
CN-113365984-A LOX inhibitors 癌症研究协会皇家癌症医院 2021-09-07 CN disclosed
EP-0714889-B1 SULFONYLSEMICARBAZIDE DERIVATIVE AND COMPOSITION FOR KEEPING CUT FLOWER FRESHNESS MEIJI SEIKA KAISHA (JP) 1998-11-25 EP disclosed
US-5723407-A Sulfonylsemicarbazide derivatives and preservative composition for preserving the freshness of flower of cut flowers MEIJI SEIKA KAISHA, LTD. (JP) 1998-03-03 US disclosed
EP-0714889-A1 SULFONYLSEMICARBAZIDE DERIVATIVE AND COMPOSITION FOR KEEPING CUT FLOWER FRESHNESS MEIJI SEIKA KAISHA LTD. (JP) 1996-06-05 EP disclosed