SCHEMBL28066629

SCHEMBL28066629

C=C(C)C(=O)Cl.C=C(C)C(N)=O

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.75
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
ALDH1A1 P00352 2/20 0.35
LDHA P00338 1/20 0.32
LDHB P07195 1/20 0.32
HSD17B10 Q99714 1/20 0.30
CRBN Q96SW2 1/20 0.30
CA4 P22748 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
1,1-Dichloroethene SCHEMBL28114594 0.90 TDP1 (0.80) TDP1LMNAALOX15BLMPMP22
SCHEMBL28173451 0.88 TDP1 (0.75) TDP1LMNAALOX15BLMPMP22
Chloromethane SCHEMBL3624400 0.87
SCHEMBL28301740 0.87 TDP1 (0.50) TDP1LMNAALOX15BLMPMP22
SCHEMBL14870 0.87
SCHEMBL35391 0.87
SCHEMBL5708652 0.87 TDP1 (1.00) TDP1LMNAALOX15BLMPMP22
SCHEMBL2128293 0.87 TDP1 (1.00) TDP1LMNAALOX15BLMPMP22
Methyl Alcohol SCHEMBL3743548 0.83
SCHEMBL4561634 0.83

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
CN-103958400-B Boron nitride agglomerated particles, composition containing the same, and three-dimensional integrated circuit having layer containing the composition 三菱化学株式会社 2016-06-29 CN disclosed