SCHEMBL5656523

SCHEMBL5656523

Cc1cc(OC2CCN(CCN)CC2)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.48
HRH1 P35367 7/20 0.48
CCR3 P51677 7/20 0.48
KDM4E B2RXH2 2/20 0.43
HRH3 Q9Y5N1 1/20 0.43
HTR1A P08908 1/20 0.43
DRD2 P14416 1/20 0.43
HTR2A P28223 1/20 0.43
HTR7 P34969 1/20 0.43
ADRA1A P35348 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FPR2 P25090 2/20 0.43
PROKR1 Q8TCW9 2/20 0.43
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ESR1 P03372 1/20 0.41

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
SCHEMBL5369447 0.88 HRH1 (0.56) HRH1CCR3KDM4EFPR2PROKR1
SCHEMBL5194926 0.81 HRH1 (0.62) HRH1CCR3KCNH2
SCHEMBL5102799 0.80 HRH1 (0.59) HRH1CCR3KDM4EFPR2PROKR1
SCHEMBL16483447 0.80 SLC6A2 (0.49) NPC1HRH1CCR3KDM4EHRH3
SCHEMBL5345951 0.79 SMN1; SMN2 (0.43) NPC1HRH1CCR3KDM4EHTR1A
SCHEMBL13176831 0.78 HRH1 (0.49) HRH1CCR3HTR1AHTR7FPR2
SCHEMBL5099023 0.78 HRH3 (0.44) HRH1CCR3HRH3DRD2HTR2A
SCHEMBL4966059 0.78 HRH1 (0.56) HRH1CCR3KCNH2
Trifluoroacetic Acid SCHEMBL6396297 0.77 CCR3 (0.53) HRH1CCR3KCNH2
SCHEMBL16483395 0.77 NPC1 (0.47) NPC1HRH1CCR3KDM4EHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7304077-B2 Chemical compounds ASTRAZENECA AB (SE) 2007-12-04 US disclosed
US-20040102432-A1 Chemical compounds ASTRAZENECA AB (SE) 2004-05-27 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-20040102432-A1 Chemical compounds CCL11, HRH1, HRH4 NPC1 842/4885HRH1 2/4885CCR3 17/4885

“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.