SCHEMBL30909386

SCHEMBL30909386

COc1cc(C#N)ccc1S(=O)(=O)c1ccc(Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.45
NR1I2 O75469 1/20 0.43
HSD11B1 P28845 1/20 0.43
IDO1 P14902 1/20 0.43
HTR6 P50406 1/20 0.42
MAPT P10636 1/20 0.41
BRPF1 P55201 7/20 0.41
BRD1 O95696 4/20 0.41
BRPF3 Q9ULD4 4/20 0.41
BRD9 Q9H8M2 3/20 0.41
BRD4 O60885 2/20 0.41
TBXA2R P21731 2/20 0.41
TRIM24 O15164 1/20 0.40
BRD7 Q9NPI1 1/20 0.40
ACLY P53396 1/20 0.40
AR P10275 2/20 0.40
ALPL P05186 1/20 0.39

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
SCHEMBL30987810 0.80 IDO1 (0.47) TRPV4HSD11B1IDO1
SCHEMBL29337077 0.80 IDO1 (0.47) TRPV4HSD11B1IDO1
SCHEMBL19682479 0.76 TRPV4 (0.70) TRPV4BRPF1BRD1BRPF3BRD9
SCHEMBL10034994 0.76 PKM (0.53) TRPV4BRPF1BRD1BRPF3BRD9
SCHEMBL29337050 0.75 IDO1 (0.62) IDO1
SCHEMBL20743622 0.74 BRPF1 (0.52) TRPV4MAPTBRPF1BRD1BRPF3
SCHEMBL30016331 0.73 SMN1; SMN2 (0.46) TRPV4IDO1ACLYALPL
SCHEMBL1798881 0.72 EPAS1 (0.49) TRPV4BRPF1BRD1BRPF3BRD9
SCHEMBL30376409 0.70 AR (0.51) MAPTAR
SCHEMBL364484 0.70 AR (0.51) MAPTAR

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
CN-117700967-A Flame-retardant unsaturated polyester resin composition and preparation method thereof 鑫双利(惠州)树脂有限公司 2024-03-15 CN claimed
CN-117700967-A Flame-retardant unsaturated polyester resin composition and preparation method thereof 鑫双利(惠州)树脂有限公司 2024-03-15 CN disclosed