SCHEMBL14368920

SCHEMBL14368920

CCCCC1CCCN(C[C@H]2CCCC[C@H]2NC)C1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.41
▸ CCR3 P51677 17/20 0.38
▸ CYP2D6 P10635 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ HTR2A P28223 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ LSS P48449 2/20 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
SCHEMBL14368642 0.86 CCR3 (0.40) CCR3CYP2D6DRD2SLC6A2HTR2A
SCHEMBL4434067 0.84 CCR3 (0.46) CCR3CYP2D6DRD2SLC6A2HTR2A
SCHEMBL14394396 0.82 CYP1A2 (0.44) CYP1A2CCR3LSS
SCHEMBL14368921 0.81 DPP4 (0.46) CYP1A2LSS
SCHEMBL14368895 0.81 DPP4 (0.46) CYP1A2LSS
SCHEMBL4433571 0.80 CCR3 (0.45) CCR3CYP2D6DRD2SLC6A2HTR2A
SCHEMBL4433523 0.80 CCR3 (0.45) CCR3CYP2D6DRD2SLC6A2HTR2A
SCHEMBL4428305 0.80 CCR3 (0.45) CCR3CYP2D6DRD2SLC6A2HTR2A
SCHEMBL14392762 0.80 LSS (0.39) CYP1A2CCR3LSS
SCHEMBL14369108 0.80 CCR3 (0.39) CCR3CYP2D6DRD2SLC6A2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — 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-20070259888-A1 Novel Compounds OPRL1, OPRM1, SIGMAR1 CYP1A2 285/4885CCR3 247/4885CYP2D6 86/4885

“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.

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