SCHEMBL8091647

SCHEMBL8091647

c1ccc(CCCCCN2CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.96

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.96
SIGMAR1 Q99720 8/20 0.74
KDM4E B2RXH2 1/20 0.65
ALDH1A1 P00352 1/20 0.65
KMT2A Q03164 1/20 0.65

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
SCHEMBL8092895 0.98 CCR3 (1.00) CCR3SIGMAR1KDM4EALDH1A1KMT2A
SCHEMBL11801794 0.93 CCR3 (0.89) CCR3SIGMAR1KDM4EALDH1A1KMT2A
SCHEMBL8092982 0.93 SIGMAR1 (0.85) CCR3SIGMAR1KMT2A
SCHEMBL6657649 0.93 CCR3 (0.82) CCR3SIGMAR1
SCHEMBL6657455 0.91 CCR3 (0.85) CCR3SIGMAR1
SCHEMBL9373668 0.87 CCR3 (0.73) CCR3SIGMAR1KDM4EALDH1A1KMT2A
SCHEMBL6659913 0.87 CCR3 (0.79) CCR3SIGMAR1KDM4EALDH1A1KMT2A
SCHEMBL30671729 0.86 SIGMAR1 (0.96) CCR3SIGMAR1
SCHEMBL10978434 0.86 CCR3 (0.72) CCR3SIGMAR1
SCHEMBL28881215 0.85 SIGMAR1 (0.93) CCR3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US disclosed
US-6057371-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-05-02 US disclosed
EP-0591426-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1994-04-13 EP disclosed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 CCR3 282/4885SIGMAR1 409/4885KDM4E 4836/4885

“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.