SCHEMBL15947702

SCHEMBL15947702

COC(CNC(=O)Cl)OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
MEN1 O00255 3/20 0.41
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 6/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 3/20 0.34
MAPT P10636 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.33
POLB P06746 2/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL6399291 0.78 CYP2D6 (0.54) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL1872795 0.78 MTNR1A (0.43) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL8179424 0.77 ALDH1A1 (0.43) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL3784058 0.76 KMT2A (0.41) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL30366355 0.76 MEN1 (0.41) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL12969433 0.74 MEN1 (0.44) KMT2AMEN1TDP1SMN1; SMN2MAPK1
SCHEMBL11006707 0.74 KMT2A (0.40) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL5666441 0.74 SMN1; SMN2 (0.42) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL18469615 0.73 KMT2A (0.39) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2
SCHEMBL13499248 0.73 MEN1 (0.39) KMT2AMEN1TDP1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2953948-B1 FLUORINATED INTEGRIN ANTAGONISTS SCIFLUOR LIFE SCIENCES INC (US) 2017-09-27 EP disclosed
WO-2014124302-A1 FLUORINATED INTEGRIN ANTAGONISTS SCIFLUOR LIFE SCIENCES, LLC (US) 2014-08-14 WO disclosed