SCHEMBL4769359

SCHEMBL4769359

CCNC(O)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 2/20 0.48
CES1 P23141 5/20 0.46
SRC P12931 1/20 0.46
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CES2 O00748 2/20 0.39
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 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
SCHEMBL6929453 0.84 KCNN4 (0.53) KCNN4ALDH1A1LMNAHTTL3MBTL1
SCHEMBL1395461 0.80 CES1 (0.50) KCNN4CES1SRCALDH1A1LMNA
SCHEMBL6443992 0.79 ALDH1A1 (0.45) CES1SRCALDH1A1LMNAHTT
SCHEMBL754131 0.77 CES1 (0.47) KCNN4CES1SRCALDH1A1L3MBTL1
SCHEMBL10384239 0.77 CES1 (0.50) KCNN4CES1SRCLMNAMEN1
SCHEMBL5483963 0.77 CES1 (0.46) KCNN4CES1SRCALDH1A1L3MBTL1
SCHEMBL1252890 0.77 CES1 (0.46) KCNN4CES1SRCALDH1A1MEN1
Hydrochloric Acid SCHEMBL19305003 0.75 CES1 (0.48) KCNN4CES1SRCLMNAMEN1
SCHEMBL5928512 0.75 CES1 (0.45) KCNN4CES1SRCALDH1A1HTT
SCHEMBL390943 0.74 CES1 (0.52) CES1SRCALDH1A1LMNAHTT

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-2007834-A1 SULPHONIUM SALT INITIATORS Ciba Holding Inc. (CH) 2008-12-31 EP disclosed
WO-2007118794-A1 SULPHONIUM SALT INITIATORS CIBA HOLDING INC. (CH) 2007-10-25 WO disclosed