SCHEMBL3669738

SCHEMBL3669738

C=CCC(CC)(C(=O)c1ccc(CN(C)CCO)cc1)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LSS P48449 2/20 0.39
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
SIGMAR1 Q99720 11/20 0.36
TMEM97 Q5BJF2 9/20 0.36
PYCR1 P32322 2/20 0.34
CHEK1 O14757 1/20 0.34
F10 P00742 1/20 0.34
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
ACKR3 P25106 1/20 0.33
OPRM1 P35372 1/20 0.32

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
SCHEMBL3428089 0.83 L3MBTL1 (0.40)
SCHEMBL13310001 0.83 EGFR (0.34)
SCHEMBL11896656 0.78 MLYCD (0.32)
SCHEMBL3424272 0.78 CYP1A2 (0.39) LSS
SCHEMBL8899051 0.78 TSHR (0.41)
SCHEMBL5675150 0.77 NR1I2 (0.43) LSS
SCHEMBL3221660 0.77 LMNA (0.34) THRBSIGMAR1ACHE
SCHEMBL9063914 0.76 SMN1; SMN2 (0.34) LSS
SCHEMBL4417684 0.76 ELANE (0.31) OPRM1
SCHEMBL8898907 0.76 PKM (0.46)

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
US-7642296-B2 2-hydroxy-1-(4-hydroxymethyl-phenyl)-2-methyl-propan-1-one, have higher reactivity at the benzylic hydroxy group and do not have a tendency to yellowing; photocurable composition for pigmented or non-pigmented varnish surface coatings CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-01-05 US disclosed
US-20070240609-A1 Photoinitiators IGM GROUP B.V. (NL) 2007-10-18 US disclosed
EP-1763499-B1 NEW PHOTOINITIATORS CIBA SC HOLDING AG (CH) 2007-09-26 EP disclosed
EP-1763499-A1 NEW PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-03-21 EP disclosed
WO-2005100292-A1 NEW PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-10-27 WO disclosed