Pimelic Acid

Pimelic Acid

SCHEMBL28874757

O=C(NC(=O)c1ccccc1)c1ccccc1.O=C(O)CCCCCC(=O)O

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 6/20 0.66
HDAC8 Q9BY41 6/20 0.66
HDAC3 O15379 4/20 0.66
HDAC4 P56524 4/20 0.66
HDAC2 Q92769 4/20 0.66
HDAC10 Q969S8 4/20 0.66
HDAC11 Q96DB2 4/20 0.66
HDAC6 Q9UBN7 4/20 0.66
HDAC9 Q9UKV0 4/20 0.66
HDAC5 Q9UQL6 4/20 0.66
HDAC7 Q8WUI4 3/20 0.66
MAPK1 P28482 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.55
MAPT P10636 2/20 0.55
LMNA P02545 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
NPSR1 Q6W5P4 1/20 0.53
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51

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
SCHEMBL27581307 0.91 HDAC1 (0.59) HDAC1HDAC8HDAC3HDAC4HDAC2
Octanedioate SCHEMBL29058741 0.89 HDAC8 (0.61) HDAC1HDAC8HDAC3HDAC4HDAC2
Hydroxyamine SCHEMBL27559058 0.88 HDAC1 (0.56) HDAC1HDAC8HDAC3HDAC4HDAC2
Azelaic Acid SCHEMBL11861583 0.86 HDAC3 (0.63) HDAC1HDAC8HDAC3HDAC4HDAC2
Sebacic Acid SCHEMBL3091757 0.86 HDAC3 (0.63) HDAC1HDAC8HDAC3HDAC4HDAC2
Benzoic Acid Hydrazide SCHEMBL15794721 0.86 HDAC3 (0.63) HDAC1HDAC8HDAC3HDAC4HDAC2
Octanedioate SCHEMBL11860281 0.86 HDAC3 (0.63) HDAC1HDAC8HDAC3HDAC4HDAC2
SCHEMBL4929881 0.85 HDAC1 (0.76) HDAC1HDAC8HDAC3HDAC4HDAC2
SCHEMBL7263142 0.85 HDAC1 (0.52) HDAC1HDAC8HDAC3HDAC4HDAC2
Benzoic Acid Hydrazide SCHEMBL11870297 0.84 HDAC3 (0.60) HDAC1HDAC8HDAC3HDAC4HDAC2

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-108368531-B Improved recombinant production method 豪夫迈·罗氏有限公司 2022-03-25 CN disclosed