SCHEMBL852409

SCHEMBL852409

O=C(CCC1CCCC1)c1ccc(Sc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
ACHE P22303 3/20 0.50
BCHE P06276 2/20 0.50
KDM4E B2RXH2 1/20 0.49
LMNA P02545 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
ALDH1A1 P00352 5/20 0.46
HPGD P15428 2/20 0.46
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KLK7 P49862 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
NFKB1 P19838 1/20 0.42

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
SCHEMBL24634194 0.99 KMT2A (0.53) KMT2AACHEBCHEKDM4ELMNA
SCHEMBL18351270 0.94 KMT2A (0.49) KMT2AACHEBCHEKDM4ELMNA
SCHEMBL28946798 0.86 KMT2A (0.69) KMT2AACHEBCHEKDM4ELMNA
SCHEMBL30702812 0.86 LMNA (0.46) KMT2ALMNAL3MBTL1ALDH1A1HPGD
SCHEMBL13912376 0.84 KMT2A (0.68) KMT2AACHEBCHEKDM4ELMNA
SCHEMBL2443481 0.84 KMT2A (0.68) KMT2AACHEBCHEKDM4ELMNA
SCHEMBL17973365 0.83 KMT2A (0.58) KMT2AACHEBCHEKDM4ELMNA
SCHEMBL22776405 0.83 FFAR1 (0.45) KMT2AACHEBCHEKDM4EALDH1A1
SCHEMBL7493236 0.82 KMT2A (0.69) KMT2AACHEBCHEKDM4ELMNA
SCHEMBL24634195 0.81 LMNA (0.42) KMT2ALMNAL3MBTL1ALDH1A1HPGD

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-2433927-B1 KETOXIME ESTER PHOTOINITIATOR CHANGZHOU TRONLY NEW ELECTRONIC MATERIALS CO LTD (CN) 2013-11-20 EP disclosed
EP-2433927-A1 KETOXIME ESTER PHOTOINITIATOR Changzhou Tronly New Electronic Materials Co., Ltd (CN) 2012-03-28 EP disclosed