SCHEMBL6837052

SCHEMBL6837052

CCCCCc1ccc(C(=O)C(O)c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.57
LMNA P02545 1/20 0.57
CES1 P23141 1/20 0.57
RARB P10826 5/20 0.55
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
RARA P10276 1/20 0.54
MAPT P10636 1/20 0.54
MTOR P42345 1/20 0.54
KMT2A Q03164 1/20 0.54
HTR2A P28223 1/20 0.52
PLA2G1B P04054 4/20 0.51
ATG4B Q9Y4P1 4/20 0.51
TRPV1 Q8NER1 1/20 0.50
NAAA Q02083 1/20 0.50
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50

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
SCHEMBL6832878 0.99 RARB (0.56) CES2LMNACES1RARBALDH1A1
SCHEMBL6836850 0.99 RARB (0.56) CES2LMNACES1RARBALDH1A1
SCHEMBL6836519 0.99 RARB (0.56) CES2LMNACES1RARBALDH1A1
SCHEMBL6838813 0.95 CES2 (0.59) CES2LMNACES1RARBALDH1A1
SCHEMBL6837054 0.94 CES2 (0.57) CES2LMNACES1RARBALDH1A1
SCHEMBL6836520 0.93 CES2 (0.56) CES2LMNACES1RARBALDH1A1
SCHEMBL6832881 0.93 CES2 (0.56) CES2LMNACES1RARBALDH1A1
SCHEMBL6836853 0.93 CES2 (0.56) CES2LMNACES1RARBALDH1A1
SCHEMBL6838814 0.90 CES2 (0.59) CES2LMNACES1RARBALDH1A1
SCHEMBL6832844 0.89 LMNA (0.62) CES2LMNACES1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0564282-A2 Bis-dithiobenzilnickel complexes for usae in near-infrared absorbing materials and benzoin derivatives as intermediates therefor NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1993-10-06 EP claimed
US-6756432-B2 POLYBUTADIENE TYPE POLYMER WITH A 1-BENZOPYRAN, A 1-BENZO PYRAN-2-ONE OR A BENZOIN DERIVATIVE; MOLDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-06-29 US disclosed
US-20030153655-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-08-14 US disclosed
EP-0564282-B1 Bis-dithiobenzilnickel complexes for use in near-infrared absorbing materials and benzoin derivatives as intermediates therefor JUJO PAPER CO LTD (JP) 1996-07-03 EP disclosed
US-5484689-A SUBSTRATE WITH OPTICAL RECORDING LAYER AND COLORLESSS DYE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1996-01-16 US disclosed
EP-0564282-A2 Bis-dithiobenzilnickel complexes for usae in near-infrared absorbing materials and benzoin derivatives as intermediates therefor NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1993-10-06 EP disclosed