SCHEMBL8923634

SCHEMBL8923634

O=C(NCCOc1ccccc1)c1cc(Cl)nc(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.68
RAB9A P51151 7/20 0.68
SMN1; SMN2 Q16637 4/20 0.68
HPGD P15428 3/20 0.68
RECQL P46063 1/20 0.65
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
LMNA P02545 1/20 0.61
MAPT P10636 1/20 0.61
HTT P42858 1/20 0.61
BRD4 O60885 1/20 0.61
POLB P06746 1/20 0.58
CASP3 P42574 1/20 0.58
SENP7 Q9BQF6 1/20 0.58
BCHE P06276 2/20 0.57
ACHE P22303 2/20 0.57
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.54
F10 P00742 1/20 0.54
MTNR1A P48039 1/20 0.54

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
SCHEMBL13996951 0.82 NPC1 (0.67) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL11424416 0.82 NPC1 (0.93) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL1578277 0.82 NPC1 (1.00) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL11433155 0.79 NPC1 (0.93) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL13996944 0.78 NPC1 (0.65) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL2836336 0.78 BCHE (0.69) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL4500939 0.77 NPC1 (0.82) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL15646615 0.76 NPC1 (0.70) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL1578589 0.76 KMT2A (0.95) NPC1RAB9ASMN1; SMN2HPGDRECQL
SCHEMBL8975296 0.75 BCHE (0.72) NPC1SMN1; SMN2HPGDKMT2AMEN1

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
JP-9249648-A None JP disclosed
JP-H09249648-A 2,6-DICHLOROISONICOTINIC ACID PHENOXYALKYLAMIDE DERIVATIVE AND AGROCHEMICAL DAINIPPON INK & CHEM INC 1997-09-22 JP disclosed