SCHEMBL8319928

SCHEMBL8319928

O=C(Nc1ccccc1)OCCCC(=O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.63
NPC1 O15118 4/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
RECQL P46063 1/20 0.63
NPSR1 Q6W5P4 2/20 0.60
TSHR P16473 1/20 0.56
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
LMNA P02545 4/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
MAPT P10636 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
ALDH1A1 P00352 1/20 0.52
CHRNA7 P36544 1/20 0.52
TP53 P04637 1/20 0.50

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
SCHEMBL8319439 0.90 RAB9A (0.56) RAB9ANPC1SMN1; SMN2RECQLNPSR1
SCHEMBL10597471 0.85 RAB9A (0.77) RAB9ANPC1SMN1; SMN2RECQLNPSR1
SCHEMBL8320641 0.84 LMNA (0.57) RAB9ANPC1SMN1; SMN2RECQLNPSR1
SCHEMBL17263428 0.83 RAB9A (0.75) RAB9ANPC1SMN1; SMN2RECQLNPSR1
SCHEMBL10817231 0.83 RAB9A (0.75) RAB9ANPC1SMN1; SMN2RECQLNPSR1
SCHEMBL8325863 0.80 CHRM3 (0.51) LMNAL3MBTL1MAPTTDP1ALDH1A1
SCHEMBL27999408 0.80 RAB9A (0.71) RAB9ANPC1SMN1; SMN2RECQLNPSR1
SCHEMBL8339054 0.80 NPSR1 (0.58) RAB9ANPC1SMN1; SMN2RECQLNPSR1
SCHEMBL7720290 0.80 TDP1 (0.64) RAB9ANPC1SMN1; SMN2NPSR1KMT2A
SCHEMBL7720286 0.80 TDP1 (0.64) RAB9ANPC1SMN1; SMN2NPSR1KMT2A

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
US-5977170-A HIGH DENISTY LIPOPROTEINS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-11-02 US disclosed
WO-1998057927-A1 ELEVATION OF HDL CHOLESTEROL BY 4-[(AMINOTHIOXOMETHYL)HYDRAZONO]-4-ARYLBUTYL CARBAMATES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-12-23 WO disclosed