SCHEMBL3931645

SCHEMBL3931645

CCCCC1(CCCC)c2ccccc2-c2cccc(-c3cc(-c4cccc5c4C(CCCC)(CCCC)c4ccccc4-5)cc(-c4cccc5c4C(CCCC)(CCCC)c4ccccc4-5)c3)c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.37
PDK2 Q15119 7/20 0.36
ELANE P08246 1/20 0.36
KDM4E B2RXH2 1/20 0.34
PKM P14618 1/20 0.34
NPSR1 Q6W5P4 3/20 0.33
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CRHBP P24387 1/20 0.33
KMT2A Q03164 1/20 0.33
CRHR2 Q13324 1/20 0.33
PGR P06401 2/20 0.33
ALOX12 P18054 1/20 0.33
LMNA P02545 1/20 0.32
CNR1 P21554 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
SCHEMBL27633898 0.90 APEX1 (0.40) APEX1PDK2ELANEKDM4EPKM
SCHEMBL3939720 0.88 PDK2 (0.36) APEX1PDK2ELANEKDM4EPKM
SCHEMBL28006780 0.84 SOAT1 (0.43) APEX1KDM4EPKMNPSR1CYP2C9
SCHEMBL1394531 0.82 APEX1 (0.50) APEX1PDK2ELANEKDM4EPKM
SCHEMBL30110388 0.82 APEX1 (0.50) APEX1PDK2ELANEKDM4EPKM
SCHEMBL5498044 0.82 PDK2 (0.37) APEX1PDK2MMP2MMP9MMP8
SCHEMBL28799915 0.81 APEX1 (0.48) APEX1PDK2ELANEKDM4EPKM
Benzene SCHEMBL27655081 0.81 APEX1 (0.53) APEX1PDK2ELANEKDM4EPKM
SCHEMBL9781136 0.81 PGR (0.44) APEX1PDK2NPSR1CYP2C9CYP3A4
SCHEMBL30606694 0.81 CYP2D6 (0.41) APEX1PDK2ELANEKDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517472-B2 Blend of viscosity modifier and luminescent compound DOW GLOBAL TECHNOLOGIES INC. (US) 2009-04-14 US claimed
US-20060197059-A1 BLEND OF VISCOSITY MODIFIER AND LUMINESCENT COMPOUND DOW GLOBAL TECHNOLOGIES INC. 2006-09-07 US claimed
WO-2004106458-A1 BLEND OF VISCOSITY MODIFIER AND LUMINESCENT COMPOUND DOW GLOBAL TECHNOLOGIES INC. (US) 2004-12-09 WO claimed
US-20040232385-A1 Blend of viscosity modifier and luminescent compound KRAM SHARI L (US) 2004-11-25 US claimed
US-7517472-B2 Blend of viscosity modifier and luminescent compound DOW GLOBAL TECHNOLOGIES INC. (US) 2009-04-14 US disclosed
US-20060197059-A1 BLEND OF VISCOSITY MODIFIER AND LUMINESCENT COMPOUND DOW GLOBAL TECHNOLOGIES INC. 2006-09-07 US disclosed
WO-2004106458-A1 BLEND OF VISCOSITY MODIFIER AND LUMINESCENT COMPOUND DOW GLOBAL TECHNOLOGIES INC. (US) 2004-12-09 WO disclosed
US-20040232385-A1 Blend of viscosity modifier and luminescent compound KRAM SHARI L (US) 2004-11-25 US disclosed