SCHEMBL5578446

SCHEMBL5578446

COc1ccc(CN2CCC3(CC2)CN(C(=O)C2CCC2)c2ccc(F)cc23)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 1/20 0.49
KDM4E B2RXH2 7/20 0.49
ALDH1A1 P00352 5/20 0.49
TDP1 Q9NUW8 1/20 0.49
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 2/20 0.44
GAA P10253 1/20 0.44
MCHR1 Q99705 1/20 0.43
MEN1 O00255 2/20 0.43
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
CCR3 P51677 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
SCHEMBL5578809 0.83 KMT2A (0.55) KDM4EALDH1A1KMT2ASMN1; SMN2POLB
SCHEMBL5578687 0.82 KMT2A (0.48) CACNA1GKDM4EALDH1A1TDP1KMT2A
SCHEMBL5578855 0.80 SIGMAR1 (0.44)
SCHEMBL5579084 0.80 OPRM1 (0.48)
SCHEMBL5579047 0.79 KMT2A (0.44) KDM4EALDH1A1KMT2ASMN1; SMN2POLB
SCHEMBL5578762 0.78 OPRM1 (0.50)
SCHEMBL5578609 0.77 OPRM1 (0.52)
SCHEMBL14366301 0.76 OPRM1 (0.38) KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL5579060 0.75 OPRM1 (0.39) KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL12084384 0.73 MEN1 (0.49) KDM4EALDH1A1KMT2ASMN1; SMN2POLB

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 CACNA1G 160/4885KDM4E 2407/4885ALDH1A1 634/4885

“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.