SCHEMBL6772579

SCHEMBL6772579

O=C(NC[C@@H]1C[C@H](Cc2ccc(F)cc2)CCN1)Nc1cccc(F)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 19/20 0.66
SLC6A2 P23975 8/20 0.66
SLC6A4 P31645 8/20 0.66
SLC6A3 Q01959 8/20 0.66
HTR2A P28223 4/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL6779282 1.00 CCR3 (0.66) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL7682490 1.00 CCR3 (0.66) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL6774097 0.94 CCR3 (0.62) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL6774155 0.94 CCR3 (0.62) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL6773032 0.91 CCR3 (0.63) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL6774725 0.91 CCR3 (0.63) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL6773332 0.91 CCR3 (0.61) CCR3SLC6A2SLC6A4SLC6A3
SCHEMBL6774376 0.91 CCR3 (0.61) CCR3SLC6A2SLC6A4SLC6A3
SCHEMBL6773223 0.91 CCR3 (0.81) CCR3SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL6769078 0.91 CCR3 (0.81) CCR3SLC6A2SLC6A4SLC6A3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6706735-B2 NITROGEN COMPOUNDS SUCH AS N-(3-(4-BENZYL-2-PIPERIDINYL)PROPYL )-N'-(3-CYANOPHENYL)UREA, USED AS CHEMOTACTIC CYTOKINE CONTROLLERS ADMINISTERED FOR PROPHYLAXIS OF ASTHMA, ALLERGIES AND AUTOIMMUNE DISEASES BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-03-16 US disclosed
US-20030144273-A1 2-substituted-4-nitrogen heterocycles as modulators of chemokine receptor activity WATSON PAUL S (US) 2003-07-31 US disclosed
US-6441001-B1 2-substituted-4-nitrogen heterocycles as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-08-27 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-20030144273-A1 2-substituted-4-nitrogen heterocycles as modulators of chemokine receptor activity CCR3, CCR1, CCR4 CCR3 1/4885SLC6A2 3713/4885SLC6A4 2663/4885

“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.