SCHEMBL5579092

SCHEMBL5579092

C=CCN1CCC2(CC1)CN(C(=O)c1c(F)cccc1F)c1c(C)ccc(C)c12

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.36
MAPK10 P53779 2/20 0.36
SIGMAR1 Q99720 1/20 0.35
LMNA P02545 1/20 0.35
BDKRB1 P46663 1/20 0.35
EPHX2 P34913 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
RORC P51449 1/20 0.33
SPR P35270 1/20 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
SCHEMBL5579040 0.90 HPGD (0.38) MAPK8MAPK10SIGMAR1OPRD1OPRK1
SCHEMBL5578898 0.87 SIGMAR1 (0.36) MAPK8MAPK10SIGMAR1LMNABDKRB1
SCHEMBL5578868 0.84 SIGMAR1 (0.35) MAPK8MAPK10SIGMAR1LMNABDKRB1
SCHEMBL5578590 0.81 EPHX2 (0.39) SIGMAR1LMNABDKRB1EPHX2OPRD1
SCHEMBL5578434 0.79 HDAC1 (0.46) SIGMAR1
SCHEMBL5578447 0.78 HPGD (0.36) MAPK8MAPK10SIGMAR1OPRD1OPRK1
SCHEMBL5579022 0.77 SIGMAR1 (0.38) SIGMAR1LMNARORC
SCHEMBL5781194 0.76 EPHX2 (0.36) LMNABDKRB1EPHX2OPRD1
SCHEMBL5578907 0.75 HPGD (0.35) SIGMAR1LMNABDKRB1OPRD1OPRK1
SCHEMBL5578516 0.75 SIGMAR1 (0.34) SIGMAR1BDKRB1OPRD1OPRK1RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US claimed
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US disclosed
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US disclosed
US-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof ARENA PHARMACEUTICALS, INC. (US) 2007-11-01 US disclosed
WO-2005063745-A9 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF ARENA PHARM INC (US) 2007-02-01 WO 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-20070254903-A1 Novel Spiroindoline or Spiroisoquinoline Compounds, Methods of Use and Compositions Thereof REN, AVPR2, RECQL MAPK8 4082/4885MAPK10 3817/4885SIGMAR1 444/4885

“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.