SCHEMBL5605546

SCHEMBL5605546

O=C(O)CCCC(=O)N1CCN(CCCCl)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 7/20 0.49
HTR1A P08908 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CYP1A2 P05177 1/20 0.49
MAPK1 P28482 1/20 0.49
SIGMAR1 Q99720 3/20 0.46
TSHR P16473 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ATM Q13315 1/20 0.46
CACNA1G O43497 2/20 0.42
ITGB3 P05106 2/20 0.42
ITGA2B P08514 2/20 0.42
NPC1 O15118 1/20 0.40
CACNA1F O60840 2/20 0.39
DRD4 P21917 2/20 0.39
DRD5 P21918 2/20 0.39
HRH2 P25021 2/20 0.39
ADRA1D P25100 2/20 0.39
HTR2A P28223 2/20 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
SCHEMBL17557979 0.92 HTR7 (0.47) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1
SCHEMBL16353682 0.83 TSHR (0.55) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1
SCHEMBL11370795 0.82 CYP1A2 (0.53) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1
SCHEMBL17558012 0.81 GLA (0.57) HTR7HTR1ASMN1; SMN2CYP1A2SIGMAR1
SCHEMBL5605766 0.81 L3MBTL1 (0.49) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1
SCHEMBL5605291 0.80 GLA (0.61) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1
SCHEMBL16353785 0.80 HTR1A (0.46) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1
SCHEMBL17558014 0.78 GLA (0.54) HTR7HTR1ASMN1; SMN2CYP1A2SIGMAR1
SCHEMBL3995285 0.78 CYP1A2 (0.39) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1
SCHEMBL5605820 0.78 HSD11B1 (0.47) HTR7HTR1ASMN1; SMN2CYP1A2MAPK1

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
US-7166594-B2 Antibacterial activity AVENTIS PHARMA S.A. (FR) 2007-01-23 US disclosed
US-20030149004-A1 Streptogramin derivatives, their preparation and compositions containing them AVENTIS PHARMA S.A. 2003-08-07 US disclosed
US-6569854-B1 Virginamycins AVENTIS PHARMA S.A. (FR) 2003-05-27 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-20030149004-A1 Streptogramin derivatives, their preparation and compositions containing them MRPL21, ABHD5, APEH HTR7 2144/4885HTR1A 3331/4885SMN1; SMN2 4757/4885

“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.