SCHEMBL30945968

SCHEMBL30945968

C=CCCCCCNC(=O)C1CCNCC1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 3/20 0.64
GNAO1 P09471 3/20 0.64
GNAI1 P63096 3/20 0.64
NAAA Q02083 1/20 0.45
KMT2A Q03164 1/20 0.45
EPHX1 P07099 1/20 0.41
PRCP P42785 2/20 0.41
PREP P48147 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
POLB P06746 1/20 0.38
HDAC8 Q9BY41 1/20 0.37
NAMPT P43490 1/20 0.36

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
SCHEMBL6017191 0.80 GNAI3 (0.97) GNAI3GNAO1GNAI1NAAAEPHX1
SCHEMBL6135546 0.79 GNAI3 (0.69) GNAI3GNAO1GNAI1NAAAEPHX1
Hydrochloric Acid SCHEMBL20542952 0.78 GNAI3 (1.00) GNAI3GNAO1GNAI1NAAAEPHX1
SCHEMBL4555068 0.78 GNAI3 (0.94) GNAI3GNAO1GNAI1NAAAEPHX1
SCHEMBL1104022 0.77 NAAA (0.43) GNAI3GNAO1GNAI1NAAAKMT2A
SCHEMBL19309524 0.76 GNAI3 (0.64) GNAI3GNAO1GNAI1NAAAEPHX1
SCHEMBL1438748 0.76 GNAI3 (0.84) GNAI3GNAO1GNAI1NAAAKMT2A
SCHEMBL670169 0.73 GNAI3 (0.60) GNAI3GNAO1GNAI1NAAAKMT2A
SCHEMBL19064233 0.72 GNAI3 (0.81) GNAI3GNAO1GNAI1NAAAEPHX1
SCHEMBL20142152 0.72 GNAI3 (0.63) GNAI3GNAO1GNAI1NAAAKMT2A

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-118146234-A 6,5,7,6-Tetracyclic derivatives, preparation method and application thereof 浙江我武翼方药业有限公司 2024-06-07 CN disclosed