SCHEMBL3824699

SCHEMBL3824699

C1=CC2(Oc3ccc4ccccc4c31)c1ccccc1-c1cc(N3CCOCC3)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.42
KDM4E B2RXH2 4/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
NPC1 O15118 2/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP1B1 Q16678 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
HTT P42858 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL3823227 0.82 SMN1; SMN2 (0.39) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL2126375 0.81 ALDH1A1 (0.54) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL7479031 0.81 SMN1; SMN2 (0.43) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL2599693 0.80 SMN1; SMN2 (0.37) PDK2KDM4EMAPTALDH1A1HPGD
SCHEMBL3861484 0.78 PIK3CA (0.34) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL12268242 0.78 KDM4E (0.34) PDK2KDM4EMAPTALDH1A1HPGD
SCHEMBL1323078 0.77 PRKDC (0.36) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL3829545 0.77 SMN1; SMN2 (0.37) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL7473370 0.76 MAPT (0.41) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL24620639 0.75 SMN1; SMN2 (0.42) KDM4EMAPTALDH1A1HPGDNPC1

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-1707610-B1 Photochromic polymerizable composition TOKUYAMA CORP (JP) 2009-09-09 EP disclosed
EP-1707610-A2 Photochromic polymerizable composition Tokuyama Corporation (JP) 2006-10-04 EP disclosed
EP-0984053-B1 PHOTOCHROMIC POLYMERIZABLE COMPOSITION TOKUYAMA CORP (JP) 2006-09-06 EP disclosed
US-6362248-B1 MIXTURE OF (METH)ACRYLATE MONOMER AND CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2002-03-26 US disclosed
EP-0984053-A1 PHOTOCHROMIC POLYMERIZABLE COMPOSITION TOKUYAMA CORPORATION (JP) 2000-03-08 EP disclosed