SCHEMBL29264336

SCHEMBL29264336

COC(=O)[C@H]1CCCN1CC1CCN(C(=O)O)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.43
CNR1 P21554 3/20 0.39
CNR2 P34972 3/20 0.39
HSD11B1 P28845 1/20 0.38
ALDH1A1 P00352 3/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
FKBP1A P62942 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
GAA P10253 1/20 0.35
PEPD P12955 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
SCHEMBL29264338 1.00 LTA4H (0.43) LTA4HCNR1CNR2HSD11B1ALDH1A1
SCHEMBL29264358 0.83 EPHX1 (0.46) CNR1CNR2ALDH1A1SMN1; SMN2KDM4E
SCHEMBL7581179 0.83 EPHX1 (0.46) CNR1CNR2ALDH1A1SMN1; SMN2KDM4E
SCHEMBL30969014 0.81 GBA1 (0.42) LTA4HCNR1CNR2HSD11B1ALDH1A1
SCHEMBL15211792 0.81 LTA4H (0.44) LTA4HCNR1CNR2HSD11B1ALDH1A1
SCHEMBL7587067 0.81 GBA1 (0.42) LTA4HCNR1CNR2HSD11B1ALDH1A1
SCHEMBL7582245 0.79 EPHX1 (0.48) CNR1CNR2ALDH1A1SMN1; SMN2FKBP1A
SCHEMBL15212209 0.77 CNR1 (0.43) LTA4HCNR1CNR2HSD11B1ALDH1A1
SCHEMBL29264319 0.77 FKBP1A (0.42) LTA4HCNR1CNR2HSD11B1ALDH1A1
SCHEMBL7585001 0.77 FKBP1A (0.42) LTA4HCNR1CNR2HSD11B1ALDH1A1

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-118271284-A Estrogen receptor modulators and uses thereof 江苏威凯尔医药科技有限公司 2024-07-02 CN disclosed