SCHEMBL6231036

SCHEMBL6231036

C1=C(C(C2=CCCCCCCCC2)=C(C2=CCCCCCCCC2)C2=CCCCCCCCC2)CCCCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 4/20 0.52
HDAC4 P56524 2/20 0.52
HDAC8 Q9BY41 2/20 0.52
HDAC6 Q9UBN7 2/20 0.52
HDAC1 Q13547 3/20 0.43
HDAC3 O15379 2/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
CTSK P43235 1/20 0.41
CCR2 P41597 1/20 0.34
KDM1A O60341 1/20 0.33

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
SCHEMBL2240854 1.00 HDAC2 (0.52) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL29046834 0.83 HDAC2 (0.52) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL28986665 0.79 HDAC2 (0.59) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL27706784 0.79 HDAC2 (0.59) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL28074385 0.79 HDAC2 (0.59) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL27412319 0.79 HDAC2 (0.59) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL29035906 0.79 HDAC2 (0.59) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL190196 0.79 HDAC2 (0.48) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL9066611 0.79 HDAC2 (0.48) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL190197 0.79 HDAC2 (0.48) HDAC2HDAC4HDAC8HDAC6HDAC1

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
EP-1187866-B1 PROCESS FOR THE PREPARATION OF MICROSTRUCTURED COMPONENTS TICONA GMBH (DE) 2005-04-13 EP claimed
US-6762265-B1 RING RETENTION FREE RADICAL COPOLYMERIZATION OF POLYCYCLIC, MONOCYLIC AND ALIPHATIC MONOMERS TICONA GMBH (DE) 2004-07-13 US claimed
CN-115884996-A Film 住友化学株式会社 2023-03-31 CN disclosed