SCHEMBL7932641

SCHEMBL7932641

FC(F)(F)c1cc(CNCC(c2ccccc2)N2CCN(CCc3ccccc3)CC2)cc(C(F)(F)F)c1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 6/20 0.57
TACR1 P25103 12/20 0.54
CCR2 P41597 1/20 0.48
SIGMAR1 Q99720 1/20 0.47

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
SCHEMBL7975422 0.93 CCR3 (0.55) CCR3TACR1CCR2
SCHEMBL7938489 0.91 CCR3 (0.59) CCR3TACR1SIGMAR1
SCHEMBL16226687 0.89 TACR1 (0.52) CCR3TACR1
SCHEMBL7987228 0.87 CCR3 (0.67) CCR3TACR1CCR2
SCHEMBL6479126 0.85 TACR1 (0.54) CCR3TACR1CCR2SIGMAR1
SCHEMBL7926034 0.84 TACR1 (0.48) CCR3TACR1
SCHEMBL7934653 0.84 CCR3 (0.60) CCR3TACR1
SCHEMBL7925814 0.83 CCR3 (0.50) CCR3TACR1SIGMAR1
SCHEMBL7934776 0.82 TACR1 (0.57) CCR3TACR1CCR2
SCHEMBL7975478 0.82 CCR3 (0.61) CCR3TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6191135-B1 Neurokinin antagonists BOEHRINGER INGELHEIM KG (DE) 2001-02-20 US claimed
US-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US disclosed
US-6235732-B1 RESPIRATORY SYSTEM DISORDERS; ANTIINFLAMMATORY AGENTS; SKIN DISORDERS BOEHRINGER INGELHEIM KG (DE) 2001-05-22 US disclosed
US-6191135-B1 Neurokinin antagonists BOEHRINGER INGELHEIM KG (DE) 2001-02-20 US disclosed
US-5985881-A TREATMENT AND PREVENTION OF RESPIRATORY DISORDERS, INFLAMMATORY EYE DISEASES, INFLAMMATORY SKIN DISEASES, INTESTINAL DISORDERS, OTHER INFLAMMATORY DISEASES BOEHRINGER INGELHEIM KG (DE) 1999-11-16 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 CCR3 282/4885TACR1 460/4885CCR2 556/4885

“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.