SCHEMBL25043883

SCHEMBL25043883

O=C1CNCCN1CC1CCOC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.37
CYP11B2 P19099 1/20 0.34
PIM1 P11309 2/20 0.34
ERCC5 P28715 1/20 0.32
FEN1 P39748 1/20 0.32
USP19 O94966 1/20 0.31
PIK3CA P42336 2/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL15000803 0.91 KDM4E (0.33) CYP11B2USP19
SCHEMBL25045245 0.87 USP19 (0.31) USP19
SCHEMBL1583511 0.82 USP19 (0.35) USP19
Hydrochloric Acid SCHEMBL2650625 0.80 USP19 (0.34) USP19
SCHEMBL4173987 0.79 USP19 (0.41) HSD11B1PIM1USP19
SCHEMBL1583393 0.79 USP19 (0.38) PIM1USP19
SCHEMBL28466818 0.78 USP19 (0.42) HSD11B1PIM1USP19
Hydrochloric Acid SCHEMBL1584061 0.78 USP19 (0.38) PIM1USP19
Bromide SCHEMBL28432857 0.78 USP19 (0.40) HSD11B1PIM1USP19
Bromide SCHEMBL28429216 0.76 USP19 (0.42) HSD11B1PIM1USP19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115703765-B Substituted triazole derivative, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2025-02-28 CN disclosed
CN-115703765-A Substituted triazole derivative, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2023-02-17 CN disclosed
WO-2023016521-A1 SUBSTITUTED TRIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 上海赛默罗生物科技有限公司 2023-02-16 WO disclosed