SCHEMBL8894092

SCHEMBL8894092

C[C](C1=CCCC1)C1=CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 4/20 0.48
HDAC4 P56524 2/20 0.48
HDAC8 Q9BY41 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
HDAC1 Q13547 3/20 0.45
HDAC3 O15379 2/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
CTSK P43235 1/20 0.43
CCR2 P41597 1/20 0.33
KDM1A O60341 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL14988865 0.97 HDAC2 (0.50) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL4449518 0.95 HDAC4 (0.48) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL3133166 0.82
SCHEMBL3133890 0.79
SCHEMBL2689130 0.78 HDAC2 (0.47) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL310711 0.78
SCHEMBL1053257 0.78
SCHEMBL1054591 0.76 HDAC4 (0.45) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL11038707 0.76 HDAC2 (0.55) HDAC2HDAC4HDAC8HDAC6HDAC1
SCHEMBL621702 0.76 HDAC2 (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343307-A1 4-Piperidinealkanamine derivatives FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS, S.A. (ES) 1989-11-29 EP claimed
WO-1997027173-A2 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-31 WO disclosed