SCHEMBL29115668

SCHEMBL29115668

O=C(O)OC(=Cc1ccccc1)C(=O)C=Cc1ccccc1.[Pd].[Pd]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
LMNA P02545 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HDAC3 O15379 2/20 0.50
HDAC4 P56524 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
PLIN1 O60240 2/20 0.50
RECQL P46063 2/20 0.50
PLIN5 Q00G26 2/20 0.50
ABHD5 Q8WTS1 2/20 0.50
F3 P13726 2/20 0.50
TNKS O95271 1/20 0.50
HCAR2 Q8TDS4 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
TNKS2 Q9H2K2 1/20 0.50

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
SCHEMBL29115842 0.98 MAPT (0.48) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL8624715 0.83 ABCG2 (0.55) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL8624713 0.83 ABCG2 (0.55) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL17377660 0.79 LMNA (0.46) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL17377661 0.79 LMNA (0.46) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL10348918 0.79 KMT2A (0.57) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL28209176 0.79 LMNA (0.46) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL26977408 0.79 MAPT (0.53) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL30825123 0.79 MAOB (0.48) MAPTLMNAALDH1A1HDAC3HDAC4
SCHEMBL11033432 0.78 MAPT (0.57) MAPTLMNAALDH1A1HDAC3HDAC4

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-117144517-A Carbon nanofiber negative electrode material applied to lithium ion battery and preparation process 江西智科新能源科技有限公司 2023-12-01 CN claimed