SCHEMBL27748314

SCHEMBL27748314

CCN(CC)C(=CC=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
HPGD P15428 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.42
PGR P06401 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
KCNH2 Q12809 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
MGLL Q99685 1/20 0.40

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
SCHEMBL8088261 0.81 ALDH1A1 (0.44) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL8088256 0.81 ALDH1A1 (0.44) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL8859065 0.80 ALDH1A1 (0.47) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL9683262 0.80 ALDH1A1 (0.43) ALDH1A1HPGDNPC1RAB9AMAPT
SCHEMBL9683260 0.80 ALDH1A1 (0.43) ALDH1A1HPGDNPC1RAB9AMAPT
SCHEMBL28919959 0.80 ALDH1A1 (0.43) ALDH1A1HPGDNPC1RAB9AMAPT
SCHEMBL12411256 0.79 ALDH1A1 (0.50) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL17955311 0.79 ALDH1A1 (0.50) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL11206642 0.74 NPC1 (0.49) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL12411252 0.74 NPC1 (0.49) ALDH1A1HPGDSMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101356241-A Hydrazide chelate complex, optical recording medium using the same, and recording method thereof MITSUBISHI CHEM CORP (JP) 2009-01-28 CN disclosed