SCHEMBL986457

SCHEMBL986457

CC(c1ccccc1)C1CC2C=CC1C2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
TSHR P16473 1/20 0.36
NPC1 O15118 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.35
CYP2D6 P10635 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 4/20 0.31
TDP1 Q9NUW8 1/20 0.31
DPP4 P27487 2/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
HPGD P15428 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL13025185 0.79 GBA1 (0.42) KDM4ETSHRNPC1RECQLRAB9A
SCHEMBL942928 0.75 KDM4E (0.40) KDM4ETSHRCYP2D6GAAALDH1A1
SCHEMBL1088788 0.72 NPC1 (0.36) KDM4ENPC1RECQLRAB9AGAA
SCHEMBL17311729 0.72 CYP2D6 (0.40) KDM4ETSHRCYP2D6GAAL3MBTL1
SCHEMBL17311731 0.72 CYP2D6 (0.40) KDM4ETSHRCYP2D6GAAL3MBTL1
SCHEMBL17311730 0.72 CYP2D6 (0.40) KDM4ETSHRCYP2D6GAAL3MBTL1
SCHEMBL17499967 0.72 CYP2D6 (0.40) KDM4ETSHRCYP2D6GAAL3MBTL1
SCHEMBL31345606 0.72 KDM4E (0.33) KDM4ENPC1RECQLRAB9AGAA
SCHEMBL6422416 0.72 ALDH1A1 (0.33) KDM4ENPC1RECQLRAB9AGAA
SCHEMBL1077813 0.72 KDM4E (0.33) KDM4ENPC1RECQLRAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009578-A1 Use Of A Combination Chain Transfer And Activating Agent To Control Molecular Weight And Optical Density Of Pd Catalyzed Norbornene Polymers PROMERUS LLC (US) 2011-01-13 US disclosed
US-7759439-B2 Use of a combination chain transfer and activating agent to control molecular weight and optical density of Pd catalyzed norbornene polymers PROMERUS LLC (US) 2010-07-20 US disclosed
US-20080242810-A1 Use of a Combination Chain Transfer and Activating Agent to Control Molecular Weight and Optical Density of Pd Catalyzed Norbornene Polymers PROMERUS LLC (US) 2008-10-02 US disclosed