SCHEMBL28958887

SCHEMBL28958887

Cc1cc(O)ccc1CCC(=O)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.47
KMT2A Q03164 1/20 0.47
NPC1 O15118 1/20 0.47
CASP3 P42574 1/20 0.47
RAB9A P51151 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
GAA P10253 1/20 0.46
DPP4 P27487 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL7199212 0.82 KMT2A (0.58) KMT2ANPC1RAB9AL3MBTL1LMNA
SCHEMBL7102470 0.82 NPSR1 (0.66) GAA
SCHEMBL28128459 0.82 KMT2A (0.55) TDP1KMT2ANPC1CASP3RAB9A
SCHEMBL7198317 0.81 F2 (0.63) KMT2ANPC1RAB9A
SCHEMBL27802926 0.80 NPSR1 (0.47)
SCHEMBL30337626 0.78 IAPP (0.47)
SCHEMBL14747983 0.78 IAPP (0.47)
SCHEMBL27638986 0.77 NPSR1 (0.53) TDP1KMT2AMAPT
SCHEMBL7193940 0.76 TRPV1 (0.62) KMT2AGAAMAPT
SCHEMBL8752791 0.75 TYR (0.58) TDP1KMT2AMAPT

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-115725988-A Electrochemical method for synthesizing spiroisoxazoline 南京林业大学 2023-03-03 CN disclosed