SCHEMBL9241971

SCHEMBL9241971

CCC(C)(C)OOOC(=O)C=CC(=O)OC(C)C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.46
CA12 O43570 1/20 0.34
AKR1B10 O60218 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
AKR1B1 P15121 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL9241966 1.00 HCAR2 (0.46) HCAR2CA12AKR1B10CA1CA2
SCHEMBL9245882 0.88 HCAR2 (0.43) HCAR2CA12AKR1B10CA1CA2
SCHEMBL9245890 0.88 HCAR2 (0.43) HCAR2CA12AKR1B10CA1CA2
SCHEMBL9244678 0.83 HCAR2 (0.52) HCAR2CA12AKR1B10CA1CA2
SCHEMBL6304123 0.83 HCAR2 (0.52) HCAR2CA12AKR1B10CA1CA2
SCHEMBL9241469 0.81 HCAR2 (0.46) HCAR2ALDH1A1TDP1KDM4EMAPT
SCHEMBL9241475 0.81 HCAR2 (0.46) HCAR2ALDH1A1TDP1KDM4EMAPT
SCHEMBL9245888 0.80 HCAR2 (0.48) HCAR2CA12AKR1B10CA1CA2
SCHEMBL9240319 0.80 HCAR2 (0.48) HCAR2CA12CA1CA2CA7
SCHEMBL9240325 0.80 HCAR2 (0.48) HCAR2CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434362-B1 Graft copolymer, solution containing the graft copolymer, and method of treating contact lens with the solution TOMEI SANGYO KK (JP) 1995-03-22 EP disclosed
US-5206298-A GRAFT COPOLYMER, SOLUTION CONTAINING THE GRAFT COPOLYMER FOR TREATING CONTACT LENS, AND METHOD OF TREATING CONTACT LENS WITH THE SOLUTION AND MAKING HYDROPHILIC LENS SURFACE TOMEI SANGYO KABUSHIKI KAISHA (JP) 1993-04-27 US disclosed
US-5134213-A N-Vinyllactam-Monoperoxyfumarate Terpolymer TOMEI SANGYO KABUSHIKI KAISHA (JP) 1992-07-28 US disclosed
US-5082912-A For graft polymerization, surfactants TOMEI SANGYO KABUSHIKI KAISHA (JP) 1992-01-21 US disclosed
EP-0434362-A1 Graft copolymer, solution containing the graft copolymer, and method of treating contact lens with the solution Tomei Sangyo Kabushiki Kaisha (JP) 1991-06-26 EP disclosed