SCHEMBL6770374

SCHEMBL6770374

C=C1CC2COC(=O)C2(Cc2ccccc2)C1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 1/20 0.73
NR3C1 P04150 1/20 0.33
AR P10275 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAOB P27338 2/20 0.31
HSD11B1 P28845 1/20 0.31
MAOA P21397 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRK1 P41145 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL6770376 1.00 GRM1 (0.73) GRM1NR3C1ARLMNAHTT
SCHEMBL7422783 0.92 GRM1 (0.67) GRM1
SCHEMBL7416569 0.87 GRM1 (0.61) GRM1OPRM1OPRK1
SCHEMBL6770051 0.86 GRM1 (0.67) GRM1
SCHEMBL6898189 0.86 GRM1 (0.67) GRM1NR3C1AR
SCHEMBL6898191 0.86 GRM1 (0.67) GRM1NR3C1AR
SCHEMBL6771084 0.86 GRM1 (0.63) GRM1L3MBTL1
SCHEMBL29360760 0.85 GRM1 (1.00) GRM1MAOBMAOA
SCHEMBL186260 0.85 GRM1 (1.00) GRM1MAOBMAOA
SCHEMBL6770377 0.84 GRM1 (0.64) GRM1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6723718-B2 GLUTAMATERGIC ANTAGONIST AND AGONISTS; ANTIISCHEMIC AND ANTISPASMODIC AGENTS; BRAIN AND NERVOUS SYSTEM DISORDERS; TRAUMA BAYER AKTIENGESELLSCHAFT (DE) 2004-04-20 US disclosed
US-20030158424-A1 Substituted alpha, beta-anellated butyrolactones STOLLE ANDREAS (DE) 2003-08-21 US disclosed
US-6462074-B1 Substituted α, β-anellated butyrolactones BAYER AKTIENGESELLSCHAFT (DE) 2002-10-08 US disclosed
EP-1047684-B1 SUBSTITUTED ALPHA,BETA-ANELLATED BUTYROLACTONES BAYER AG (DE) 2002-10-02 EP 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-20030158424-A1 Substituted alpha, beta-anellated butyrolactones GABRB2, GABRB3, GABRB1 GRM1 74/4885NR3C1 887/4885AR 4109/4885

“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.