Benzene

Benzene

SCHEMBL28280701

CC(=NO)c1ccccc1.c1ccccc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CA9 Q16790 1/20 0.52
CYP2D6 P10635 2/20 0.50
MAPT P10636 2/20 0.50
CASP3 P42574 1/20 0.50
GFER P55789 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
CYP1A2 P05177 1/20 0.50
HSD17B10 Q99714 1/20 0.50
POLB P06746 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 2/20 0.47
ATM Q13315 1/20 0.47
METTL3 Q86U44 1/20 0.47
G6PC1 P35575 1/20 0.47

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
SCHEMBL257242 1.00 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CA9
SCHEMBL45278 1.00 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CA9
SCHEMBL2736631 1.00 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CA9
SCHEMBL28059930 0.97 LMNA (0.50) LMNAMAPK1HTTL3MBTL1CA9
SCHEMBL27945945 0.97 LMNA (0.50) LMNAMAPK1HTTL3MBTL1CA9
SCHEMBL11235227 0.97 LMNA (0.50) LMNAMAPK1HTTL3MBTL1CA9
Water SCHEMBL4312372 0.97 LMNA (0.50) LMNAMAPK1HTTL3MBTL1CA9
SCHEMBL11266105 0.97 LMNA (0.50) LMNAMAPK1HTTL3MBTL1CA9
SCHEMBL4279171 0.95 CA9 (0.48) LMNAMAPK1HTTL3MBTL1CA9
Methoxymethane SCHEMBL25296693 0.93 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CA9

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-109401716-A A kind of preparation method of rapid crystallization water-based polyurethane adhesive 福建华夏蓝新材料科技有限公司 2019-03-01 CN disclosed