SCHEMBL29090804

SCHEMBL29090804

O=C(O)CCCCCCCNC(=O)c1cccc(Cl)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.72
MAPK1 P28482 1/20 0.67
FABP4 P15090 1/20 0.66
HDAC3 O15379 3/20 0.62
HDAC1 Q13547 3/20 0.62
NAMPT P43490 1/20 0.61
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
TMEM97 Q5BJF2 1/20 0.58
SIGMAR1 Q99720 1/20 0.58
POLB P06746 1/20 0.58
HDAC4 P56524 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC8 Q9BY41 2/20 0.55

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
SCHEMBL30594162 1.00 LMNA (0.72) LMNAMAPK1FABP4HDAC3HDAC1
SCHEMBL9489991 0.91 NAMPT (0.70) LMNAHDAC3HDAC1NAMPTMEN1
SCHEMBL9491028 0.91 NAMPT (0.70) LMNAHDAC3HDAC1NAMPTMEN1
SCHEMBL30481056 0.85 LMNA (0.72) LMNAMAPK1HDAC3HDAC1NAMPT
SCHEMBL5657986 0.85 LMNA (0.72) LMNAMAPK1HDAC3HDAC1NAMPT
SCHEMBL10865398 0.84 MAPK1 (0.86) LMNAMAPK1HDAC3HDAC1CYP1A2
SCHEMBL10659200 0.84 MAPK1 (0.86) LMNAMAPK1HDAC3HDAC1CYP1A2
SCHEMBL1231651 0.84 MAPK1 (0.86) LMNAMAPK1HDAC3HDAC1CYP1A2
SCHEMBL5655215 0.84 MAPK1 (0.86) LMNAMAPK1HDAC3HDAC1CYP1A2
SCHEMBL21320455 0.84 LMNA (0.70) LMNAMAPK1FABP4HDAC3HDAC1

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-116897206-A Oral delivery of PCSK 9-targeting antisense conjugates 四纬生物制药股份有限公司 2023-10-17 CN claimed
CN-117545509-A Oral delivery of oligonucleotides 四纬生物制药股份有限公司 2024-02-09 CN disclosed
CN-116897206-A Oral delivery of PCSK 9-targeting antisense conjugates 四纬生物制药股份有限公司 2023-10-17 CN disclosed