SCHEMBL29686404

SCHEMBL29686404

CN(c1cc(N2CCOCC2)ccc1N)S(C)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 4/20 0.52
MAPT P10636 7/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 3/20 0.41
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 2/20 0.41
PKM P14618 1/20 0.41
CYP2C9 P11712 1/20 0.41
PRKDC P78527 2/20 0.41
PTK2 Q05397 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 2/20 0.40
XDH P47989 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 2/20 0.39
ALOX15 P16050 2/20 0.39
AKR1C3 P42330 1/20 0.39

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
SCHEMBL24498537 1.00 LGMN (0.52) LGMNMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL20073418 0.87 LMNA (0.44) LGMNMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL26121387 0.86 MAPT (0.50) MAPTSMN1; SMN2ALDH1A1GAALMNA
SCHEMBL24498526 0.85 MAPT (0.52) MAPTSMN1; SMN2ALDH1A1GAALMNA
SCHEMBL26513075 0.84 MAPT (0.42) LGMNMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL24497560 0.84 MAPT (0.43) LGMNMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL24498232 0.82 MAPT (0.40) LGMNMAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL27181513 0.80 MAPT (0.63) MAPTSMN1; SMN2ALDH1A1LMNAPKM
SCHEMBL2060694 0.77 LGMN (0.54) LGMNMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL20073397 0.76 TYK2 (0.48) TSHRKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283954-A Hydroxamate compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-06-23 CN disclosed
CN-114901656-B Hydroximic acid ester compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-04-07 CN disclosed
CN-114901656-A Hydroximic acid ester compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2022-08-12 CN disclosed
WO-2022117016-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳微芯生物科技股份有限公司 2022-06-09 WO disclosed