SCHEMBL6417482

SCHEMBL6417482

CC(C)N1CC(CN2CCC(Cc3cc(F)ccc3Cl)CC2)COC1=O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 7/20 0.37
CCR5 P51681 2/20 0.37
HTR1A P08908 1/20 0.35
SLC6A4 P31645 1/20 0.35
HRH1 P35367 5/20 0.34
P2RX7 Q99572 2/20 0.34
DPP4 P27487 1/20 0.34

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
SCHEMBL6410034 0.90 SLC6A4 (0.39) CCR3HTR1ASLC6A4P2RX7
SCHEMBL6412127 0.89 SLC6A4 (0.42) CCR3CCR5HTR1ASLC6A4
SCHEMBL6410720 0.87 HTR1A (0.51) CCR3CCR5HTR1ASLC6A4HRH1
SCHEMBL6411535 0.86 HTR1A (0.47) CCR3HTR1ASLC6A4HRH1
SCHEMBL6418105 0.85 HTR2B (0.48) CCR3CCR5HTR1ASLC6A4HRH1
SCHEMBL6417821 0.85 HTR1A (0.45) CCR3HTR1ASLC6A4HRH1
SCHEMBL6417597 0.85 CCR3 (0.39) CCR3CCR5HRH1
SCHEMBL6414678 0.85 CCR3 (0.37) CCR3CCR5HTR1ASLC6A4P2RX7
SCHEMBL6411768 0.82 SIGMAR1 (0.37) CCR3CCR5SLC6A4HRH1P2RX7
SCHEMBL6416520 0.82 P2RX7 (0.41) CCR3CCR5HTR1ASLC6A4P2RX7

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-20050065140-A1 Serotonine reuptake inhibitor SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2005-03-24 US disclosed
EP-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP 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-20050065140-A1 Serotonine reuptake inhibitor HTR1A, SLC6A4, SLC6A2 CCR3 4569/4885CCR5 1463/4885HTR1A 1/4885

“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.