SCHEMBL30865688

SCHEMBL30865688

CCCCCC(CC)c1ccnnc1N

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.36
ADA P00813 1/20 0.32

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
SCHEMBL29790270 0.98 NR1I2 (0.38) NR1I2ADA
SCHEMBL30620836 0.83 ADA (0.35) ADA
SCHEMBL29814520 0.77 ADA (0.39) NR1I2ADA
SCHEMBL22260113 0.75 NR1I2 (0.37) NR1I2ADA
SCHEMBL22260101 0.74 NR1I2 (0.38) NR1I2ADA
SCHEMBL29814823 0.73 NOS2 (0.39) ADA
SCHEMBL1301338 0.71 NR1I2 (0.38) NR1I2
SCHEMBL22260121 0.71 NR1I2 (0.38) NR1I2ADA
SCHEMBL14155074 0.71 NR1I2 (0.35) NR1I2
SCHEMBL8524531 0.70 NR1I2 (0.45) NR1I2

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-117794933-A Phenol derivatives for modulating BRM 基因泰克公司 2024-03-29 CN disclosed