SCHEMBL30608945

SCHEMBL30608945

O=C(O)N1CCC1Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.43
CHRNA7 P36544 1/20 0.43
HTR3A P46098 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.41
EPHX2 P34913 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RIPK1 Q13546 1/20 0.38
HRH1 P35367 1/20 0.38
CTSV O60911 1/20 0.38
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSH P09668 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
CTSC P53634 1/20 0.38

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
SCHEMBL5010541 0.90 ALDH1A1 (0.51) CHRNA7HTR3AALDH1A1SMN1; SMN2GAA
SCHEMBL29077551 0.80 USP30 (0.49) USP30GAARIPK1KDM4E
SCHEMBL30440955 0.76 ALDH1A1 (0.44) CHRNA7HTR3AALDH1A1SMN1; SMN2GAA
SCHEMBL2098375 0.73 EPHX2 (0.45) USP30ALDH1A1EPHX2SLC6A2SLC6A3
SCHEMBL2098373 0.73 EPHX2 (0.45) USP30EPHX2SLC6A2SLC6A3FFAR4
SCHEMBL30387268 0.72 KMT2A (0.42) CHRNA7HTR3AALDH1A1GAAMEN1
SCHEMBL13733403 0.71 CTSV (0.42) USP30CHRNA7HTR3AALDH1A1SMN1; SMN2
SCHEMBL19028116 0.71 ALDH1A1 (0.44) CHRNA7HTR3AALDH1A1SMN1; SMN2GAA
SCHEMBL26136601 0.71 SMN1; SMN2 (0.47) CHRNA7ALDH1A1SMN1; SMN2GAANPC1
SCHEMBL5271411 0.71 EPHX2 (0.59) EPHX2HRH1SCD5SRD5A1

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-116964049-A Estrogen receptor modulators 里科瑞尔姆IP控股有限责任公司 2023-10-27 CN disclosed