SCHEMBL2495997

SCHEMBL2495997

Cc1ccc(O[C]=O)c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.52
CYP2A6 P11509 3/20 0.41
ALDH1A1 P00352 1/20 0.35
IMPDH2 P12268 1/20 0.35
IMPDH1 P20839 1/20 0.35
HTT P42858 1/20 0.35
IDO1 P14902 1/20 0.34
TSHR P16473 3/20 0.33
MAPT P10636 2/20 0.33
EP300 Q09472 1/20 0.33
KAT8 Q9H7Z6 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PABPC1 P11940 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 2/20 0.32
ESR1 P03372 2/20 0.32
KMT2A Q03164 2/20 0.32
ESR2 Q92731 2/20 0.32
PLK1 P53350 1/20 0.32
GAA P10253 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
SCHEMBL7840651 0.82 IDO1 (0.53) CYP1A2ALDH1A1IMPDH2IMPDH1HTT
SCHEMBL27730 0.77 ALDH1A1 (0.48) ALDH1A1HTTTSHRMAPTKDM4E
SCHEMBL49632 0.74 TSHR (0.43) CYP1A2ALDH1A1TSHRKDM4ESMN1; SMN2
SCHEMBL637626 0.74 CYP1A2 (0.62) CYP1A2CYP2A6ALDH1A1IMPDH2IMPDH1
SCHEMBL29712920 0.73 CYP1A2 (0.68) CYP1A2CYP2A6ALDH1A1TSHRMAPT
SCHEMBL9824756 0.73 CYP1A2 (0.68) CYP1A2CYP2A6ALDH1A1TSHRMAPT
SCHEMBL2502170 0.73 NCEH1 (0.53) CYP1A2CYP2A6ALDH1A1TSHRMAPT
SCHEMBL14950810 0.72 CYP1A2 (0.59) CYP1A2CYP2A6ALDH1A1IMPDH2IMPDH1
SCHEMBL97030 0.72 NCEH1 (0.34) MAPT
SCHEMBL161370 0.72 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1HTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431663-B2 Polymer and method for producing same TOKYO INSTITUTE OF TECHNOLOGY (JP) 2013-04-30 US disclosed
US-8389656-B2 Copolymer and method for producing same TOKYO INSTITUTE OF TECHNOLOGY (JP) 2013-03-05 US disclosed
US-20110245441-A1 POLYMER AND METHOD FOR PRODUCING SAME TOKYO INSTITUTE OF TECHNOLOGY (JP) 2011-10-06 US disclosed
US-20110245440-A1 COPOLYMER AND METHOD FOR PRODUCING SAME TOKYO INSTITUTE OF TECHNOLOGY (JP) 2011-10-06 US disclosed
EP-0454501-B1 Benzylidenethiazolidine derivatives, their preparation and their use for the inhibition of lipid peroxides SANKYO CO (JP) 2001-09-05 EP disclosed
EP-0839812-A1 Preparation of benzylthiazolidine derivatives Sankyo Company Limited (JP) 1998-05-06 EP disclosed
US-5387596-A Treating arteriosclerosis SANKYO COMPANY, LIMITED (JP) 1995-02-07 US disclosed
EP-0454501-A2 Benzylidenethiazolidine derivatives, their preparation and their use for the inhibition of lipid peroxides Sankyo Company Limited (JP) 1991-10-30 EP disclosed
US-4859759-A Siloxane containing benzotriazolyl/tetraalkylpiperidyl substituent KIMBERLY-CLARK CORPORATION (US) 1989-08-22 US disclosed