Benzene

Benzene

SCHEMBL29067363

O=C(c1ccccc1)C1(O)CCCCC1.c1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.46
FASN P49327 2/20 0.44
AKR1C1 Q04828 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.42
LMNA P02545 2/20 0.42
DAO P14920 1/20 0.41
TSHR P16473 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD11B1 P28845 1/20 0.41
ADRB2 P07550 1/20 0.40

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
SCHEMBL27279 1.00 HDAC4 (0.46) HDAC4FASNAKR1C1KMT2AMEN1
SCHEMBL6695613 1.00 HDAC4 (0.46) HDAC4FASNAKR1C1KMT2AMEN1
SCHEMBL28231289 1.00 HDAC4 (0.46) HDAC4FASNAKR1C1KMT2AMEN1
Water SCHEMBL29044078 0.98 HDAC4 (0.44) HDAC4FASNAKR1C1KMT2AMEN1
SCHEMBL6692163 0.98 AKR1C1 (0.45) HDAC4FASNAKR1C1KMT2AMEN1
Methyl Alcohol SCHEMBL28651962 0.96 KDM4E (0.44) HDAC4FASNAKR1C1KMT2AMEN1
SCHEMBL28095639 0.96 KDM4E (0.44) HDAC4FASNAKR1C1KMT2AMEN1
Acetone SCHEMBL8418701 0.94 KDM4E (0.43) HDAC4FASNAKR1C1KMT2AMEN1
Benzophenone SCHEMBL451083 0.94 ALDH1A1 (0.52) HDAC4FASNAKR1C1KMT2AMEN1
Urea SCHEMBL28321664 0.94 POLB (0.43) HDAC4FASNAKR1C1KMT2AMEN1

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-116730654-A Hydroxyapatite ceramic slurry for photocuring three-dimensional printing and preparation method thereof 山东科技大学 2023-09-12 CN disclosed