SCHEMBL19742741

SCHEMBL19742741

CC(C)COC(=O)C(C)C.CCOC(=O)CC(C)CC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.36
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
TSHR P16473 3/20 0.32
ALDH1A1 P00352 2/20 0.32
TRPA1 O75762 1/20 0.32
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL1866533 0.87 GAA (0.43) MMP8MGAMGAASIMGAM2
SCHEMBL873392 0.87 GAA (0.43) MMP8MGAMGAASIMGAM2
SCHEMBL27696749 0.81 MGAM (0.38) MMP8MGAMGAASIMGAM2
SCHEMBL19742725 0.78 CYP19A1 (0.35) MMP8MGAMGAASIMGAM2
SCHEMBL13050770 0.76 MMP1 (0.31) MMP8
SCHEMBL94333 0.74 CYP2D6 (0.33)
SCHEMBL12157088 0.74 MAPT (0.43)
SCHEMBL8041406 0.74 NAAA (0.33) ALDH1A1
SCHEMBL2455247 0.74 TSHR (0.37) MMP8GAATSHRALDH1A1TDP1
SCHEMBL11340674 0.73 MGAM (0.46) MGAMGAASIMGAM2TSHR

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
US-20170371244-A1 COMPOSITION FOR FORMING UPPER LAYER FILM, PATTERN FORMING METHOD, RESIST PATTERN, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2017-12-28 US disclosed