SCHEMBL4607337

SCHEMBL4607337

CC(=O)OC1C2C=CC(C)(C2)C1OC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
KMT2A Q03164 1/20 0.33
ABCB1 P08183 4/20 0.33
KCNJ5 P48544 3/20 0.33
KCNJ3 P48549 3/20 0.33
ALDH1A1 P00352 1/20 0.32
ESR1 P03372 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL9647555 0.82 APLNR (0.32)
SCHEMBL3907947 0.68 TSHR (0.33) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL10965463 0.67 HTT (0.33) HTT
SCHEMBL12342891 0.67 APLNR (0.35)
SCHEMBL28805653 0.67 CYP3A4 (0.33) TSHRKMT2AKCNJ5KCNJ3ALDH1A1
SCHEMBL18145188 0.66 POLA1 (0.33) SMN1; SMN2
SCHEMBL2832119 0.66 POLB (0.38)
SCHEMBL20349477 0.66 POLB (0.38)
SCHEMBL1791944 0.65 POLB (0.33)
SCHEMBL9254035 0.63 POLB (0.43) TSHRKMT2AALDH1A1

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-1803761-B1 Ring-opened copolymer, hydrogenated ring-opened copolymer, process for producing thereof, and compositions ZEON CORP (JP) 2016-04-27 EP disclosed
EP-1408064-B1 OPEN-RING COPOLYMER, HYDROGENATED OPEN-RING COPOLYMER, PROCESSES FOR PRODUCTION OF BOTH, AND COMPOSITIONS ZEON CORP (JP) 2008-07-30 EP disclosed
EP-1803761-A1 Ring-opened copolymer, hydrogenated ring-opened copolymer, process for producing thereof, and compositions ZEON CORPORATION (JP) 2007-07-04 EP disclosed
US-6995226-B2 Open-ring copolymer, hydrogenated open-ring copolymer, process for production of both, and compositions ZEON CORPORATION (JP) 2006-02-07 US disclosed
US-20040152843-A1 Open-ring copolymer, hydrogenated open-ring copolymer, process for production of both, and compositions ZEON CORPORATION (JP) 2004-08-05 US disclosed
EP-1408064-A1 OPEN-RING COPOLYMER, HYDROGENATED OPEN-RING COPOLYMER, PROCESSES FOR PRODUCTION OF BOTH, AND COMPOSITIONS Zeon Corporation (JP) 2004-04-14 EP disclosed