SCHEMBL6415433

SCHEMBL6415433

CCCc1n(C)cc[n+]1C.F[B-](F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 4/20 0.41
APOBEC3A P31941 2/20 0.40
APOBEC3G Q9HC16 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL372970 0.92 HDAC8 (0.46) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
Fluoride Ion SCHEMBL1898517 0.90 HDAC8 (0.45) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
SCHEMBL16673992 0.82 HDAC8 (0.52) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
SCHEMBL372853 0.81 HDAC8 (0.47) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
Sulfuric Acid SCHEMBL21195035 0.81 HTT (0.45) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
Sulfuric Acid SCHEMBL21195036 0.80 HTT (0.47) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
SCHEMBL1835131 0.79 HDAC8 (0.42) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL30980120 0.79 HDAC8 (0.45) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
Fluoride Ion SCHEMBL1894046 0.79 HDAC8 (0.45) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E
Trifluoromethanesulfonic Acid SCHEMBL17179987 0.79 HTT (0.42) HDAC8APOBEC3AAPOBEC3GSMN1; SMN2KDM4E

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-1604378-A2 ELECTRIC DOUBLE-LAYER CAPACITOR Advanced Capacitor Technologies, Inc. (JP) 2005-12-14 EP disclosed
WO-2004079759-A2 ELECTRIC DOUBLE-LAYER CAPACITOR ADVANCED CAPACITOR TECHNOLOGIES, INC. (JP) 2004-09-16 WO disclosed