SCHEMBL29758264

SCHEMBL29758264

O=C(O)CCn1ccc2cc(Cl)c(Cl)cc21

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 3/20 0.70
▸ HDAC6 Q9UBN7 5/20 0.53
▸ HDAC1 Q13547 2/20 0.53
▸ HDAC8 Q9BY41 1/20 0.53
▸ MCL1 Q07820 3/20 0.44
▸ S1PR1 P21453 2/20 0.44
▸ OXER1 Q8TDS5 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KRAS P01116 1/20 0.43
▸ MAPT P10636 1/20 0.42

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
SCHEMBL28734993 1.00 KMO (0.70) KMOHDAC6HDAC1HDAC8MCL1
SCHEMBL1576323 0.83 KMO (0.78) KMOS1PR1OXER1LMNA
SCHEMBL10253582 0.76 KMO (0.68) KMOMCL1LMNAMAPT
SCHEMBL29758270 0.76 KMO (0.56) KMOMCL1S1PR1LMNAKRAS
SCHEMBL13345643 0.76 KMO (0.56) KMOMCL1S1PR1LMNAMAPT
SCHEMBL26684010 0.76 KMO (0.68) KMOMCL1S1PR1LMNA
SCHEMBL19100386 0.76 KMO (0.56) KMOMCL1S1PR1LMNAKRAS
SCHEMBL29684637 0.75 LMNA (0.73) KMOLMNA
SCHEMBL526317 0.75 LMNA (0.73) KMOLMNA
SCHEMBL23612457 0.74 KMO (0.54) KMOS1PR1OXER1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114456699-A Seawater alternation resistant marine antifouling paint and preparation method thereof 嘉兴学院 2022-05-10 — — CN claimed
CN-114456699-A Seawater alternation resistant marine antifouling paint and preparation method thereof 嘉兴学院 2022-05-10 — — CN disclosed
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