SCHEMBL5579422

SCHEMBL5579422

O=C(c1cccc2ccccc12)N1CCC2(CC1)CN(CCc1ccccc1)c1ccc(Cl)cc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 1/20 0.51
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
PTGDR2 Q9Y5Y4 2/20 0.42
PTGER2 P43116 1/20 0.42
PTGDR Q13258 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
RIPK1 Q13546 1/20 0.40
TACR1 P25103 1/20 0.40
FFAR2 O15552 1/20 0.40
DRD4 P21917 1/20 0.39
USP2 O75604 1/20 0.39
CYP46A1 Q9Y6A2 1/20 0.39
CCR5 P51681 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
SCHEMBL3728319 0.75 HDAC1 (0.52) PTGDR2RIPK1
SCHEMBL5579336 0.72 DRD4 (0.50) AVPR1ADRD4
SCHEMBL5579248 0.70 AVPR1A (0.53) AVPR1AMEN1KMT2ATACR1USP2
SCHEMBL5578487 0.70 GRIN2B (0.60) AVPR1AMEN1KMT2APTGDR2PTGDR
SCHEMBL5578553 0.69 HDAC1 (0.49) TACR1
SCHEMBL5578574 0.69 HDAC1 (0.51) TACR1
SCHEMBL5578601 0.67 AVPR1A (0.43) AVPR1AMEN1KMT2AUSP2
SCHEMBL5578865 0.66 HTT (0.47) MEN1KMT2AUSP2
SCHEMBL5578667 0.66 SIGMAR1 (0.47) MEN1KMT2A
SCHEMBL4453090 0.66 ALDH1A1 (0.77) AVPR1AMEN1KMT2AUSP2

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 AVPR1A 48/4885MEN1 882/4885KMT2A 1940/4885

“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.