SCHEMBL30729285

SCHEMBL30729285

COc1ccccc1-c1nc(-c2ccc(C)cc2)no1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 13/20 0.77
RAB9A P51151 13/20 0.77
NPC1 O15118 12/20 0.77
TP53 P04637 9/20 0.77
HSD17B10 Q99714 6/20 0.77
RXFP1 Q9HBX9 1/20 0.77
GAA P10253 2/20 0.74
ALDH1A1 P00352 6/20 0.73
NFKB1 P19838 4/20 0.73
NFKB2 Q00653 4/20 0.73
RELA Q04206 4/20 0.73
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
HPGD P15428 2/20 0.73
L3MBTL1 Q9Y468 4/20 0.65
MAPK1 P28482 2/20 0.65
MAPT P10636 6/20 0.61
KDM4E B2RXH2 5/20 0.61
TSHR P16473 2/20 0.61
TDP1 Q9NUW8 2/20 0.61

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
SCHEMBL3428143 1.00 SMN1; SMN2 (0.77) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL7961699 0.89 SMN1; SMN2 (0.81) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL14147338 0.87 SMN1; SMN2 (0.75) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL16716023 0.85 SMN1; SMN2 (1.00) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL12171135 0.83 SMN1; SMN2 (0.70) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL5660762 0.80 RAB9A (0.61) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL7958390 0.79 TTR (0.55) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL23288082 0.78 CASP3 (0.71) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL12692348 0.78 RAB9A (0.67) SMN1; SMN2RAB9ANPC1TP53HSD17B10
SCHEMBL11732877 0.77 ALDH1A1 (0.64) SMN1; SMN2RAB9ANPC1TP53HSD17B10

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-117377478-A Methods and compositions for regenerating hair cells in the inner ear of an adult mammal 麻省眼耳科医院 2024-01-09 CN disclosed