SCHEMBL6802316

SCHEMBL6802316

Oc1ccc2c(c1)CC1(C2)Cc2ccc(O)cc2/C1=C/c1ccccc1O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.46
MAOB P27338 4/20 0.39
MAOA P21397 3/20 0.39
CISD1 Q9NZ45 1/20 0.39
TYR P14679 3/20 0.37
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
NAT1 P18440 1/20 0.34
CYP26A1 O43174 2/20 0.34
CHRNA7 P36544 2/20 0.33

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
SCHEMBL6802016 0.83 MAOB (0.48) MIFMAOBMAOAESR1ESR2
SCHEMBL6800031 0.83 MAOB (0.48) MIFMAOBMAOAESR1ESR2
SCHEMBL6796287 0.80 MAOB (0.46) MIFMAOBMAOACYP26A1
SCHEMBL6797976 0.80 MAOB (0.46) MIFMAOBMAOACYP26A1
SCHEMBL6940051 0.73 MIF (0.51) MIF
SCHEMBL6800928 0.73 CES2 (0.53) MIFMAOBMAOACYP26A1
SCHEMBL6802315 0.73 CES2 (0.53) MIFMAOBMAOACYP26A1
SCHEMBL6806457 0.73 MAOB (0.47) MAOBMAOA
SCHEMBL6799865 0.73 MAOB (0.47) MAOBMAOA
SCHEMBL6794708 0.68 PBRM1 (0.46) MAOBMAOAESR1ESR2

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-20040082642-A1 Novel estrogen receptor ligands and method III MERCK & CO., INC. 2004-04-29 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-20040082642-A1 Novel estrogen receptor ligands and method III ESRRA, ESRRB, FSHR MIF 881/4885MAOB 1020/4885MAOA 953/4885

“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.