SCHEMBL13710053

SCHEMBL13710053

CC(C)(OC(=O)C1CCCC(O)C1)C1CCC2OC2C1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 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
SCHEMBL15326127 0.93 BTK (0.32) BTKCHRM2CHRM1CHRM3
SCHEMBL13707397 0.86 PPM1B (0.33)
SCHEMBL13954445 0.84 BTK (0.31) BTKCHRM2CHRM1CHRM3
SCHEMBL13710056 0.81
SCHEMBL22372968 0.77 BTK (0.32) BTK
SCHEMBL15326065 0.76
SCHEMBL13710054 0.76
SCHEMBL12653036 0.75 PPM1B (0.34)
SCHEMBL13954447 0.75 PPM1B (0.34)
SCHEMBL11920529 0.75 BTK (0.45) BTKCHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090234040-A1 ACTIVE ENERGY RAY-CURABLE INK COMPOSITION, STORAGE CONTAINER FOR ACTIVE ENERGY RAY-CURABLE INK COMPOSITION, AND METHOD FOR STORING ACTIVE ENERGY RAY-CURABLE INK COMPOSITION KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2009-09-17 US disclosed
US-7399797-B2 Cationic polymerizable composition, actinic ray curable ink-jet ink and stabilization method of the cationic polymerizable composition KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-15 US disclosed