SCHEMBL23486802

SCHEMBL23486802

N#CB1CCC(C(=O)NCCO)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.37
▸ CTSL P07711 1/20 0.36
▸ CTSB P07858 1/20 0.36
▸ CTSK P43235 1/20 0.36
▸ NAAA Q02083 1/20 0.35
▸ KEAP1 Q14145 1/20 0.34
▸ NFE2L2 Q16236 1/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ GNAI3 P08754 1/20 0.33
▸ GNAO1 P09471 1/20 0.33
▸ GNAI1 P63096 1/20 0.33
▸ EPHX1 P07099 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ LTA4H P09960 2/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ PKM P14618 1/20 0.31

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
SCHEMBL3987516 0.78 — —
SCHEMBL19301621 0.74 NAAA (0.52) LMNANAAAKEAP1NFE2L2KMT2A
SCHEMBL15739433 0.74 NAAA (0.56) LMNACTSLCTSBCTSKNAAA
SCHEMBL61529 0.72 NAAA (0.59) LMNACTSLCTSBCTSKNAAA
SCHEMBL23486736 0.71 ALDH1A1 (0.31) —
SCHEMBL23486500 0.70 GAA (0.34) KMT2A
SCHEMBL16727379 0.69 NAAA (0.43) LMNANAAAKMT2AGNAI3GNAO1
SCHEMBL2750425 0.69 LMNA (0.41) LMNANAAAKEAP1NFE2L2KMT2A
SCHEMBL670169 0.69 GNAI3 (0.60) LMNANAAAKMT2AGNAI3GNAO1
SCHEMBL8443294 0.69 KMT2A (0.42) LMNANAAAKEAP1NFE2L2KMT2A

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
WO-2021110076-A1 OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE 深圳信立泰药业股份有限公司 2021-06-10 — — WO disclosed
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