SCHEMBL6799152

SCHEMBL6799152

COc1ccc2c(c1)CC1(CCc3ccc(OC)cc3C1=O)C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.49
ADRA2A P08913 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAOB P27338 2/20 0.47
DRD2 P14416 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
CYP19A1 P11511 2/20 0.45
PRNP P04156 1/20 0.45
PPIB P23284 1/20 0.45
MAPK14 Q16539 2/20 0.44
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MAOA P21397 1/20 0.43
ACHE P22303 1/20 0.42

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
SCHEMBL6801984 0.93 SIGMAR1 (0.54) METAP1ADRA2ASMN1; SMN2MAOBDRD2
SCHEMBL6795634 0.91 SMN1; SMN2 (0.56) METAP1ADRA2ASMN1; SMN2MAOBDRD2
SCHEMBL6798898 0.91 SMN1; SMN2 (0.43) METAP1ADRA2ASMN1; SMN2MAOBDRD2
SCHEMBL14409344 0.88 HTR2A (0.53) METAP1SMN1; SMN2MAOBDRD2HTR2A
SCHEMBL6800097 0.88 METAP1 (0.54) METAP1ADRA2ASMN1; SMN2MAOBCYP19A1
SCHEMBL8779124 0.85 HTR2A (0.51) METAP1SMN1; SMN2MAOBDRD2HTR2A
SCHEMBL6796533 0.84 SMN1; SMN2 (0.55) ADRA2ASMN1; SMN2MAOBDRD2HTR2A
SCHEMBL6796152 0.84 SMN1; SMN2 (0.53) METAP1ADRA2ASMN1; SMN2MAOBDRD2
SCHEMBL11805867 0.84 METAP1 (0.47) METAP1SMN1; SMN2MAOBDRD2HTR2A
SCHEMBL13004977 0.83 SIGMAR1 (0.62) METAP1SMN1; SMN2MAOBDRD2HTR2A

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 METAP1 4145/4885ADRA2A 237/4885SMN1; SMN2 2695/4885

“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.