SCHEMBL28548591

SCHEMBL28548591

CC1(C)C2CCC1(CCO)C(=O)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
F2 P00734 2/20 0.54
PRSS1 P07477 2/20 0.54
PRSS2 P07478 2/20 0.54
PRSS3 P35030 2/20 0.54
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 2/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA5A P35218 4/20 0.43
CA5B Q9Y2D0 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL22432809 1.00 KMT2A (0.55) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL27763833 0.90 KMT2A (0.52) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL27784739 0.90 KMT2A (0.52) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL27669444 0.89 KMT2A (0.61) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL7520016 0.86 KMT2A (0.58) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL16678505 0.86 KMT2A (0.58) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL16678503 0.86 KMT2A (0.58) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL18130153 0.86 KMT2A (0.58) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL15681900 0.84 KMT2A (0.56) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL10319390 0.83 KMT2A (0.59) KMT2AF2PRSS1PRSS2PRSS3

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-108605996-B Cinnamomum camphora-based biological algicide and preparation method thereof 浙江农林大学 2021-04-23 CN claimed
CN-108605996-B Cinnamomum camphora-based biological algicide and preparation method thereof 浙江农林大学 2021-04-23 CN disclosed
CN-108605996-B Cinnamomum camphora-based biological algicide and preparation method thereof 浙江农林大学 2021-04-23 CN disclosed