SCHEMBL20752121

SCHEMBL20752121

O=S1(=O)CCCN1c1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.50
FEN1 P39748 3/20 0.50
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PARP1 P09874 2/20 0.43
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MGLL Q99685 1/20 0.39
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.38
PER2 O15055 1/20 0.38
CRY1 Q16526 1/20 0.38
CRY2 Q49AN0 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL15915546 0.79 ALOX5AP (0.41) ALOX5APFEN1TP53MGLLPOLB
SCHEMBL29190662 0.79 ALOX5AP (0.47) ALOX5APFEN1MEN1KMT2ATP53
SCHEMBL15786413 0.77 PARP1 (0.47) ALOX5APFEN1PARP1TP53
SCHEMBL3987697 0.77 ALOX5AP (0.41) ALOX5APFEN1PARP1TP53ALDH1A1
SCHEMBL12163537 0.75 ALOX5AP (0.43) ALOX5APFEN1MEN1KMT2APARP1
SCHEMBL22041218 0.75 FAAH (0.44) ALOX5APFEN1TP53ALDH1A1MGLL
SCHEMBL15419716 0.75 MEN1 (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1MGLL
SCHEMBL14355849 0.75 ADRA2C (0.49) ALOX5APFEN1KMT2APOLB
SCHEMBL15916682 0.74 CA1 (0.46) ALOX5APFEN1TP53MGLLPOLB
SCHEMBL14356048 0.73 ADRB1 (0.49) ALDH1A1HSD17B10TSHR

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
EP-2928891-B1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2019-02-20 EP disclosed