SCHEMBL854923

SCHEMBL854923

[CH2]Nc1ccc(F)cc1C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
MAPT P10636 4/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
BRD4 O60885 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL854924 0.79 ALDH1A1 (0.44) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8064140 0.77 ALDH1A1 (0.44) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL21844929 0.77 ALDH1A1 (0.42) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL11421284 0.77 ALDH1A1 (0.44) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL4288310 0.77 ALDH1A1 (0.42) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL1777530 0.76 HTT (0.46) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL2095539 0.76 RAPGEF4 (0.56) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL1811188 0.76 ALDH1A1 (0.41) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8943130 0.74 MEN1 (0.42) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL14017786 0.74 LMNA (0.41) ALDH1A1MAPTLMNAMEN1KMT2A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1857443-B1 Therapeutic morpholino-substituted compounds ASTRAZENECA AB (SE) 2012-03-28 EP claimed
JP-4820518-B2 2011-11-24 JP claimed
EP-1857443-A2 Therapeutic morpholino-substituted compounds AstraZeneca AB (SE) 2007-11-21 EP claimed
US-6977255-B2 Therapeutic morpholino-substituted compounds KINACIA PTY. LTD. (AU) 2005-12-20 US claimed
JP-2003530318-A 2003-10-14 JP claimed
EP-1257537-A4 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS KINACIA PTY LTD (AU) 2003-04-23 EP claimed
EP-1257537-A1 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS Kinacia Pty Ltd (AU) 2002-11-20 EP claimed
WO-2001053266-A1 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS KINACIA PTY LTD. (AU) 2001-07-26 WO claimed