SCHEMBL28837360

SCHEMBL28837360

CC(O)CSc1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IFNAR1 P17181 1/20 0.41
ALDH1A1 P00352 4/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 2/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 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
Acrylic Acid SCHEMBL28837346 0.87 LMNA (0.43) ALDH1A1LMNAHDAC3HDAC4HDAC1
SCHEMBL23391645 0.85 BACE1 (0.45) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL29715998 0.85 BACE1 (0.45) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL2117027 0.85 IFNAR1 (0.44) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL7445715 0.78 HDAC3 (0.44) ALDH1A1LMNAHDAC3HDAC4HDAC1
SCHEMBL7445725 0.78 HDAC3 (0.44) ALDH1A1LMNAHDAC3HDAC4HDAC1
SCHEMBL11097562 0.76 KMT2A (0.48) ALDH1A1LMNAMAPK1MEN1HPGD
SCHEMBL11853227 0.76 MAOA (0.42) LMNAMEN1HPGDKMT2AMAOA
SCHEMBL9342243 0.76 CYP1A2 (0.45) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL11855729 0.76 P4HB (0.45) ALDH1A1LMNAMEN1HPGDKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116568669-A Substituted mono-and poly-benzene nuclear monomers and polymers thereof for volume Bragg gratings 元平台技术有限公司 2023-08-08 CN disclosed
CN-116457336-A Substituted propane nuclear monomer for volume Bragg grating and polymer thereof 元平台技术有限公司 2023-07-18 CN disclosed
CN-114728889-A Aromatic substituted alkane-nuclear monomers and polymers thereof for volume bragg gratings 脸谱科技有限责任公司 2022-07-08 CN disclosed