SCHEMBL28853609

SCHEMBL28853609

CC(C)(C)OC(=O)N1CCCN(CCCN=[N+]=[N-])CCCN(C(=O)OC(C)(C)C)CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.41
▸ USP2 O75604 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ KEAP1 Q14145 1/20 0.37
▸ NFE2L2 Q16236 1/20 0.37
▸ CTSK P43235 1/20 0.37
▸ EPHX1 P07099 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ ACKR3 P25106 1/20 0.35
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNB4 P30926 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35
▸ TPSAB1 Q15661 1/20 0.35

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
SCHEMBL31706305 0.97 MEN1 (0.41) HPGDUSP2SMN1; SMN2MEN1KMT2A
SCHEMBL28853610 0.95 HPGD (0.38) HPGDUSP2SMN1; SMN2MEN1KMT2A
SCHEMBL23301354 0.92 TLR8 (0.42) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL14270252 0.83 USP2 (0.47) HPGDUSP2SMN1; SMN2MEN1KMT2A
SCHEMBL27567860 0.82 HPGD (0.47) HPGDUSP2SMN1; SMN2MEN1KMT2A
SCHEMBL16898492 0.81 USP2 (0.39) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL16898400 0.80 USP2 (0.38) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL16898385 0.80 USP2 (0.38) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL16898644 0.80 USP2 (0.38) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL16898465 0.80 USP2 (0.38) USP2SMN1; SMN2TLR8CHRM2CHRM1

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-111533744-B Non-viral vector, preparation method and application thereof 德州学院 2022-10-04 — — CN disclosed
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