SCHEMBL5578627

SCHEMBL5578627

C=CCN1CCC2(CC1)CN(C(=O)c1ccccc1Cl)Cc1ccccc12

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.49
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 2/20 0.41
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
HSD11B1 P28845 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
KMT2A Q03164 1/20 0.39
NAMPT P43490 1/20 0.39
KCNA5 P22460 1/20 0.38
MCHR1 Q99705 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTR2B P41595 1/20 0.37
MAPK14 Q16539 1/20 0.37

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
SCHEMBL5578508 0.88 SIGMAR1 (0.49) SIGMAR1ALDH1A1LMNAHTTRAB9A
SCHEMBL5578829 0.85 SIGMAR1 (0.47) SIGMAR1ALDH1A1LMNAHPGDHTT
SCHEMBL5578570 0.83 SIGMAR1 (0.47) SIGMAR1ALDH1A1LMNAHPGDHTT
SCHEMBL5578696 0.83 SIGMAR1 (0.47) SIGMAR1ALDH1A1LMNAHSD11B1KMT2A
SCHEMBL5578603 0.82 SIGMAR1 (0.46) SIGMAR1
SCHEMBL5578643 0.82 SIGMAR1 (0.49) SIGMAR1ALDH1A1LMNAHTTRAB9A
SCHEMBL5578682 0.81 KMT2A (0.47) SIGMAR1ALDH1A1LMNARAB9AKMT2A
SCHEMBL5578489 0.81 HDAC1 (0.48) SIGMAR1RAB9A
SCHEMBL5578863 0.81 SIGMAR1 (0.48) SIGMAR1ALDH1A1HTTRAB9AKCNA5
SCHEMBL5578565 0.81 SIGMAR1 (0.42) SIGMAR1RAB9AKMT2ACYP2C9CYP2C19

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 SIGMAR1 444/4885ALDH1A1 634/4885LMNA 471/4885

“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.