SCHEMBL5578951

SCHEMBL5578951

O=C(Nc1ccccc1)N1CC2(CCN(CC3CC3)CC2)c2cc(F)ccc21

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 6/20 0.43
OPRM1 P35372 1/20 0.43
OPRK1 P41145 1/20 0.43
OPRL1 P41146 1/20 0.43
FAAH O00519 2/20 0.39
KCNH2 Q12809 1/20 0.39
CCR2 P41597 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL5578913 0.91 MAPT (0.48) OPRM1OPRK1OPRL1KCNH2CCR2
SCHEMBL14366330 0.90 CCR3 (0.53) CCR3
SCHEMBL5578592 0.89 CCR3 (0.44) CCR3OPRM1OPRK1OPRL1CCR2
SCHEMBL5578723 0.88 MEN1 (0.42) CCR3OPRM1OPRK1OPRL1MAPK1
SCHEMBL5578850 0.87 OPRM1 (0.43) CCR3OPRM1OPRK1OPRL1KCNH2
SCHEMBL5579306 0.85 HDAC1 (0.48) OPRM1OPRK1OPRL1
SCHEMBL14366329 0.85 POLB (0.52) CCR3OPRM1OPRK1OPRL1KCNH2
SCHEMBL5578445 0.84 KCNH2 (0.51) OPRM1OPRK1OPRL1KCNH2
SCHEMBL5579000 0.83 OPRM1 (0.49) CCR3OPRM1OPRK1OPRL1TSHR
SCHEMBL5578846 0.83 OPRM1 (0.43) OPRM1OPRK1OPRL1KCNH2

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 CCR3 1022/4885OPRM1 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.