SCHEMBL10523974

SCHEMBL10523974

Cc1ccccc1C(=O)NC1CCCN1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.60
RAB9A P51151 1/20 0.60
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
GLA P06280 1/20 0.50
TAS1R3 Q7RTX0 2/20 0.47
TAS1R1 Q7RTX1 2/20 0.47
TAS1R2 Q8TE23 2/20 0.47
POLB P06746 2/20 0.46
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL7673616 0.82 ALDH1A1 (0.56) NPC1RAB9AALDH1A1HPGDGAA
SCHEMBL25143774 0.78 DDB1 (0.47) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL1674869 0.77 NPC1 (0.69) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL1278937 0.77 NPC1 (0.69) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL1278935 0.77 NPC1 (0.69) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL15983801 0.76 NPC1 (0.73) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13162641 0.76 NPC1 (0.90) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13162659 0.76 NPC1 (0.97) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL457993 0.76 NPC1 (0.84) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL594263 0.76 NPC1 (0.72) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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
EP-0320630-A1 Enantiometric iodobenzamides THE VANDERBILT UNIVERSITY (US) 1989-06-21 EP disclosed