SCHEMBL4621810

SCHEMBL4621810

CCCOc1cc(C=O)ccc1OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 1/20 0.60
KDM4E B2RXH2 2/20 0.56
LMNA P02545 1/20 0.56
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
FDPS P14324 1/20 0.54
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
GSK3B P49841 1/20 0.50
MAPK1 P28482 2/20 0.49
NTSR1 P30989 2/20 0.49
MAPT P10636 2/20 0.49
HTT P42858 2/20 0.49
APP P05067 2/20 0.49
GAA P10253 1/20 0.49
PKM P14618 1/20 0.49
HPGD P15428 1/20 0.49
AKR1C3 P42330 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 2/20 0.49

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
SCHEMBL11734711 1.00 TACR2 (0.60) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL23006056 0.92 TACR2 (0.57) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL5216691 0.92 TACR2 (0.57) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL14856161 0.91 TACR2 (0.56) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL584489 0.90 TACR2 (0.62) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL29446267 0.90 TACR2 (0.62) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL1609108 0.89 TACR2 (0.75) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL662145 0.89 TACR2 (0.75) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL16052363 0.88 TACR2 (0.67) TACR2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL15952102 0.88 TACR2 (0.60) TACR2KDM4ELMNAALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0860455-B1 Photocrosslinkable polymers ROLIC AG (CH) 2008-06-04 EP disclosed
WO-2005119252-A2 MODULATORS OF GPR35 FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS ARENA PHARMACEUTICALS, INC. (US) 2005-12-15 WO disclosed
CN-1124297-C Photocrosslinkable polymers ROLIC AG (CH) 2003-10-15 CN disclosed
US-6632909-B2 Alkylenedi- acrylates and acrylamides containing phenyl groups substituted with at least two alkoxy or fluoroalkoxy groups; use in orientation layers for liquid crystals, and in optical components, in particular hybrid layer elements. ROLIC AG (CH) 2003-10-14 US disclosed
US-20020061996-A1 Photocrosslinkable polymers BUCHECKER RICHARD (CH) 2002-05-23 US disclosed
CN-1194996-A Photocrosslinkable polymers ROLIC AG (CH) 1998-10-07 CN disclosed
EP-0860455-A2 Photocrosslinkable polymers Rolic AG (CH) 1998-08-26 EP disclosed