SCHEMBL27747780

SCHEMBL27747780

C=CC(=O)NOC(C)(C)CCC

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 6/20 0.34
ALDH1A1 P00352 4/20 0.34
TDP1 Q9NUW8 2/20 0.34
MAPK1 P28482 1/20 0.34
CYP3A4 P08684 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HPGD P15428 1/20 0.32
NFKB1 P19838 1/20 0.30
ADRA1A P35348 1/20 0.30
RAB9A P51151 1/20 0.30
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL27769001 0.80 ZDHHC20 (0.37) ZDHHC20ZDHHC2LMNAHSD17B10TSHR
SCHEMBL31413363 0.76 LMNA (0.39) LMNAHSD17B10TSHRALDH1A1TDP1
SCHEMBL27387249 0.76 TSHR (0.39) ZDHHC20ZDHHC2TSHRALDH1A1TDP1
SCHEMBL3683889 0.74 ZDHHC20 (0.35) ZDHHC20ZDHHC2TSHRALDH1A1TDP1
SCHEMBL18469669 0.73 ZDHHC20 (0.34) ZDHHC20ZDHHC2LMNAHSD17B10TSHR
SCHEMBL4906709 0.71 KMT2A (0.53) ZDHHC20ZDHHC2LMNAHSD17B10TSHR
SCHEMBL9398270 0.71 ALDH1A1 (0.42) ZDHHC20ZDHHC2LMNAHSD17B10TSHR
SCHEMBL1108010 0.71 TSHR (0.44) LMNAHSD17B10TSHRALDH1A1MAPK1
SCHEMBL9766457 0.69 ZDHHC20 (0.40) ZDHHC20ZDHHC2TSHRALDH1A1TDP1
SCHEMBL21728862 0.68 ZDHHC20 (0.44) ZDHHC20ZDHHC2HSD17B10TSHRALDH1A1

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
CN-101473420-B Mold release composition, method for manufacturing TFT substrate, and method for recycling mold release composition IDEMITSU KOSAN CO 2010-09-22 CN disclosed
CN-101473420-A Mold release composition, method for manufacturing TFT substrate, and method for recycling mold release composition IDEMITSU KOSAN CO (JP) 2009-07-01 CN disclosed