SCHEMBL21391327

SCHEMBL21391327

Cc1ccc(NC(=O)c2ccccc2)cc1OC1CCNCC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
MAPT P10636 2/20 0.59
MEN1 O00255 1/20 0.59
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
CSF1R P07333 1/20 0.50
PDGFRB P09619 1/20 0.50
KIT P10721 1/20 0.50
DDR1 Q08345 1/20 0.50
FKBP5 Q13451 1/20 0.50
BCL9 O00512 4/20 0.49
CTNNB1 P35222 4/20 0.49
KCNH2 Q12809 1/20 0.48
SCN5A Q14524 1/20 0.48
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MAOA P21397 1/20 0.47

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 SCHEMBL29635006 0.99 KMT2A (0.58) KMT2AMAPTMEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL21381313 0.99 KMT2A (0.58) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL20695992 0.85 KIT (0.69) KMT2AMAPTMEN1RAB9ACSF1R
Hydrochloric Acid SCHEMBL28911136 0.85 KIT (0.68) KMT2AMEN1RAB9ACSF1RPDGFRB
SCHEMBL28320364 0.80 KIT (0.54) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL21391333 0.80 KIT (0.58) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL21391326 0.79 KIT (0.57) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL21391331 0.79 KIT (0.77) KMT2AMAPTMEN1CSF1RPDGFRB
SCHEMBL21391343 0.78 KIT (0.58) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL14347581 0.77 KMT2A (0.74) KMT2AMAPTMEN1NPC1RAB9A

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
WO-2019178801-A1 NOVEL PHENOXY PIPERIDINE DERIVATIVE AND USES THEREOF 中国科学院合肥物质科学研究院 2019-09-26 WO disclosed