SCHEMBL7866937

SCHEMBL7866937

CCNCCOc1ccc(NC(=O)C2CCOC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACACB O00763 2/20 0.45
MAPT P10636 3/20 0.45
POLB P06746 3/20 0.45
LMNA P02545 1/20 0.45
KMT2A Q03164 3/20 0.44
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 1/20 0.43
NAMPT P43490 1/20 0.43
MEN1 O00255 2/20 0.42
RAB9A P51151 1/20 0.42
ENPP3 O14638 1/20 0.42
ENPP1 P22413 1/20 0.42
ENPP2 Q13822 1/20 0.42
ABL1 P00519 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
MAPK14 Q16539 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
Hydrochloric Acid SCHEMBL7862111 0.99 ACACB (0.45) ACACBMAPTPOLBLMNAKMT2A
SCHEMBL7869835 0.93 MAPT (0.49) MAPTPOLBLMNAKMT2AHSD17B10
Hydrochloric Acid SCHEMBL7862079 0.92 MAPT (0.48) MAPTPOLBLMNAKMT2AHSD17B10
Hydrochloric Acid SCHEMBL7867062 0.91 MAPT (0.46) ACACBMAPTPOLBLMNAKMT2A
Hydrochloric Acid SCHEMBL7874015 0.89 POLB (0.44) ACACBMAPTPOLBLMNAKMT2A
SCHEMBL7862201 0.85 ACACB (0.47) ACACBMAPTPOLBLMNAKMT2A
Hydrochloric Acid SCHEMBL7869860 0.84 ACACB (0.46) ACACBMAPTPOLBLMNAKMT2A
Hydrochloric Acid SCHEMBL7869908 0.84 NAMPT (0.43) ACACBMAPTPOLBLMNAKMT2A
Hydrochloric Acid SCHEMBL7862065 0.84 MAPT (0.49) MAPTPOLBLMNAKMT2AHSD17B10
SCHEMBL7869785 0.78 HRH3 (0.49) MAPTPOLBLMNAKMT2AHSD17B10

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
US-6300368-B1 FOR THERAPY OF ATRIAL ARRHYTHMIA MITSUI CHEMICALS, INC. (JP) 2001-10-09 US disclosed
EP-0968999-A1 Anilide derivatives and antiarrhythmic agents containing the same Mitsui Chemicals, Inc. (JP) 2000-01-05 EP disclosed