SCHEMBL5578620

SCHEMBL5578620

O=C1c2ccccc2-c2cccc(C(=O)N3CC4(CCN(CC5CC5)CC4)c4cc(F)ccc43)c21

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.42
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42
GLA P06280 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
DRD2 P14416 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
AXL P30530 2/20 0.36
MERTK Q12866 2/20 0.36
CYP2D6 P10635 1/20 0.36
CSNK1D P48730 1/20 0.36

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
SCHEMBL5578621 0.86 OPRM1 (0.43) OPRL1OPRM1OPRK1SIGMAR1AXL
SCHEMBL5579955 0.84 KDM2B (0.43) OPRL1OPRM1OPRK1ALDH1A1AXL
SCHEMBL5578880 0.84 KDM2B (0.42) OPRL1OPRM1OPRK1AXLMERTK
SCHEMBL5578801 0.84 OPRM1 (0.42) OPRL1OPRM1OPRK1DRD2SIGMAR1
SCHEMBL5578452 0.82 KDM2B (0.45) OPRL1OPRM1OPRK1ALDH1A1LMNA
SCHEMBL5578896 0.82 OPRM1 (0.45) OPRL1OPRM1OPRK1DRD2SIGMAR1
SCHEMBL5578605 0.82 OPRM1 (0.45) OPRL1OPRM1OPRK1DRD2SIGMAR1
SCHEMBL5579306 0.82 HDAC1 (0.48) OPRL1OPRM1OPRK1DRD2SIGMAR1
SCHEMBL5578998 0.81 OPRM1 (0.44) OPRL1OPRM1OPRK1ALDH1A1CYP2D6
SCHEMBL14366293 0.81 OPRM1 (0.45) OPRL1OPRM1OPRK1SIGMAR1AXL

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 8 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
WO-2005063745-A9 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF ARENA PHARM INC (US) 2007-02-01 WO claimed
EP-1716148-A2 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF Arena Pharmaceuticals, Inc. (US) 2006-11-02 EP claimed
WO-2005063745-A2 NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF ARENA PHARMACEUTICALS, INC. (US) 2005-07-14 WO 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 OPRL1 240/4885OPRM1 630/4885OPRK1 131/4885

“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.