SCHEMBL8537336

SCHEMBL8537336

CC(CO)Oc1cccnc1SC(C)C

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 8/20 0.37
ALOX5AP P20292 5/20 0.36
FEN1 P39748 5/20 0.36
POLB P06746 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL8534582 0.85 ALOX5AP (0.35) FFAR4ALOX5APFEN1POLBKMT2A
SCHEMBL9023974 0.80 ALOX5AP (0.37) FFAR4ALOX5APFEN1POLBKMT2A
SCHEMBL9023632 0.76 ALOX5AP (0.37) FFAR4ALOX5APFEN1POLBKMT2A
SCHEMBL8535452 0.75 F9 (0.39) FFAR4POLBKMT2AMEN1HSD17B10
SCHEMBL1584954 0.72 MEN1 (0.44) FFAR4ALOX5APFEN1KMT2AMEN1
SCHEMBL11303009 0.72 MTNR1A (0.47) KMT2AALDH1A1LMNA
SCHEMBL14092100 0.72 PPIA (0.36) ALOX5APFEN1POLBKMT2AMEN1
SCHEMBL14092081 0.71 MEN1 (0.35) ALOX5APFEN1POLBKMT2AMEN1
SCHEMBL18517443 0.71 MEN1 (0.35) ALOX5APFEN1POLBKMT2AMEN1
SCHEMBL14047149 0.70 ALOX5AP (0.36) ALOX5APFEN1POLBKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0540697-B1 SULFONYLUREAS CIBA GEIGY AG (CH) 1998-06-03 EP disclosed
US-5625071-A HERBICIDES CIBA-GEIGY CORPORATION (US) 1997-04-29 US disclosed
US-5403814-A Preemergence and postemergence herbicides CIBA-GEIGY CORPORATION (US) 1995-04-04 US disclosed
EP-0540697-A1 NOVEL SULFONYLUREAS Novartis AG (CH) 1993-05-12 EP disclosed
WO-1992016522-A1 NOVEL SULFONYLUREAS CIBA-GEIGY AG (CH) 1992-10-01 WO disclosed