SCHEMBL6761606

SCHEMBL6761606

CCOC(=O)C1(C(=O)OCC)CCC2(CC1)NCCc1cc(OC)ccc12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 4/20 0.38
AR P10275 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
ALOX15 P16050 1/20 0.36
KDM1A O60341 1/20 0.36
LMNA P02545 3/20 0.36
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
HTT P42858 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 2/20 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
SCHEMBL6760152 0.88 OPRM1 (0.33) KMT2A
SCHEMBL6761571 0.86 ESR2 (0.40) KMT2AALDH1A1LMNAKDM4EHPGD
SCHEMBL6760148 0.84 KMT2A (0.37) CYP2C19KMT2AALDH1A1LMNAKDM4E
SCHEMBL6761417 0.81 ALDH1A1 (0.47) KMT2AALDH1A1KDM4EHPGD
SCHEMBL6759721 0.77 OPRM1 (0.32) KMT2AALDH1A1KDM4EHPGD
SCHEMBL1222499 0.77 KDM1A (0.45) ARKDM1A
SCHEMBL6760145 0.76 KDM1A (0.41) CYP2C19ARKDM1A
SCHEMBL6760141 0.76 KDM1A (0.41) CYP2C19ARKDM1A
SCHEMBL19995876 0.75 KMT2A (0.41) CYP2C19KMT2AALDH1A1SMN1; SMN2ALOX15
SCHEMBL12311978 0.74 KDM1A (0.43) ARKDM1A

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
US-20040106635-A1 having small-conductance potassium channel (SK) blocking activity TANABE SEIYAKU CO., LTD. (JP) 2004-06-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040106635-A1 having small-conductance potassium channel (SK) blocking activity KCNN1, KCNN2, KCNN3 CYP2C19 900/4885KMT2A 1633/4885AR 1238/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.