SCHEMBL20144644

SCHEMBL20144644

CC(C)(C)CC(C)(C(=O)OCCOC(=O)C1C2CCC(O2)C1C(=O)O)C(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 4/20 0.59
PTPN1 P18031 3/20 0.59
PPP1CC P36873 3/20 0.59
TFPI2 P48307 5/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
GMNN O75496 1/20 0.42
PMP22 Q01453 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
THPO P40225 1/20 0.42
PPP5C P53041 2/20 0.35
PPP2CA P67775 1/20 0.35
NPY4R P50391 1/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL1104061 0.81 PPM1B (0.68) PPM1BPTPN1PPP1CCTFPI2KDM4E
SCHEMBL19141478 0.78 ALDH1A1 (0.48) KDM4ELMNATSHRALDH1A1HTT
SCHEMBL14063656 0.77 PPM1B (0.59) PPM1BPTPN1PPP1CCTFPI2KDM4E
SCHEMBL18467271 0.76 ADRB2 (0.40) MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL18757205 0.75 TP53 (0.35) TP53
SCHEMBL18047221 0.75 PPM1B (1.00) PPM1BPTPN1PPP1CCTFPI2KDM4E
SCHEMBL20144605 0.73 BTK (0.37)
SCHEMBL12216353 0.72 PPM1B (0.67) PPM1BPTPN1PPP1CCTFPI2KDM4E
SCHEMBL18757017 0.72 MAPK1 (0.33) TSHRMEN1ALDH1A1HTTKMT2A
SCHEMBL14398380 0.72 PPM1B (1.00) PPM1BPTPN1PPP1CCTFPI2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2102708-B1 CURABLE COMPOSITION, COLOR FILTER, AND MANUFACTURING METHOD OF THE SAME FUJIFILM CORP (JP) 2018-05-16 EP disclosed