SCHEMBL4917873

SCHEMBL4917873

COc1ccccc1N1CCN(CCCCN(C(N)=O)c2c(-c3ccccc3)nc3ccc(Cl)nn23)CC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
DRD3 P35462 8/20 0.46
FAAH O00519 4/20 0.46
ADRA1D P25100 3/20 0.46
ADRA1A P35348 3/20 0.46
ADRA1B P35368 3/20 0.46
DRD2 P14416 4/20 0.46
DRD4 P21917 2/20 0.46
KCNH2 Q12809 1/20 0.46
HTR1A P08908 2/20 0.45
CTSS P25774 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44

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
SCHEMBL4967479 0.87 KDM4E (0.49) KDM4EALDH1A1TDP1DRD3FAAH
SCHEMBL4916834 0.81 DRD2 (0.58) KDM4EALDH1A1TDP1DRD3ADRA1D
SCHEMBL4916690 0.78 MEN1 (0.49) KDM4EALDH1A1TDP1DRD3ADRA1D
SCHEMBL4915589 0.76 DRD2 (0.50) KDM4EALDH1A1TDP1DRD3ADRA1D
SCHEMBL4918534 0.74 HTR2A (0.53) KDM4EALDH1A1TDP1DRD3ADRA1D
SCHEMBL5507888 0.72 DRD2 (0.62) KDM4EALDH1A1TDP1DRD3ADRA1D
SCHEMBL4917959 0.72 DRD2 (0.49) KDM4EALDH1A1TDP1DRD3ADRA1D
SCHEMBL4907682 0.71 DRD2 (0.53) KDM4EALDH1A1TDP1DRD3ADRA1A
Hydrochloric Acid SCHEMBL19580067 0.71 DRD3 (0.62) KDM4EALDH1A1TDP1DRD3FAAH
SCHEMBL4915621 0.71 DRD2 (0.50) KDM4EALDH1A1TDP1DRD3ADRA1D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778685-B1 INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF SANOL ARZNEI SCHWARZ GMBH (DE) 2008-03-26 EP claimed
US-20080051409-A1 Indolizine Carboxamides and Aza and Diaza Derivatives Thereof SCHWARZ PHARMA AG (DE) 2008-02-28 US claimed
US-20080051409-A1 Indolizine Carboxamides and Aza and Diaza Derivatives Thereof SCHWARZ PHARMA AG (DE) 2008-02-28 US 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-20080051409-A1 Indolizine Carboxamides and Aza and Diaza Derivatives Thereof GRIN2A, GRIN2C, GRIN1 KDM4E 776/4885ALDH1A1 459/4885TDP1 3602/4885

“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.