SCHEMBL6675017

SCHEMBL6675017

CC(C)(F)CC[C@@H](C[C@@H](O)[C@@H](N)Cc1ccccc1)C(=O)NCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 8/20 0.61
REN P00797 3/20 0.44
LAP3 P28838 3/20 0.44
ANPEP P15144 1/20 0.44
RNPEP Q9H4A4 1/20 0.44
DNPEP Q9ULA0 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
MMP8 P22894 1/20 0.41
CSNK1E P49674 1/20 0.40

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
SCHEMBL7591156 1.00 CCR1 (0.61) CCR1RENLAP3ANPEPRNPEP
SCHEMBL4068003 0.94 CCR1 (0.58) CCR1ALDH1A1CYP3A4MMP8
SCHEMBL4071980 0.92 CCR1 (0.54) CCR1REN
SCHEMBL4067803 0.90 CCR1 (0.56) CCR1ANPEPALDH1A1CYP3A4
SCHEMBL4062733 0.89 CCR1 (0.51) CCR1RENALDH1A1
SCHEMBL6832278 0.89 CCR1 (0.58) CCR1RENLAP3ANPEPRNPEP
SCHEMBL4064045 0.89 CCR1 (0.61) CCR1RENLAP3ANPEPRNPEP
SCHEMBL6169670 0.89 CCR1 (0.61) CCR1RENLAP3ANPEPRNPEP
SCHEMBL4064275 0.89 CCR1 (0.58) CCR1RENLAP3ANPEPRNPEP
SCHEMBL4068540 0.89 CCR1 (0.51) CCR1ALDH1A1

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
WO-2004039375-A1 METHODS OF USING CCR1 ANTAGONISTS AS IMMUNOMODULATORY AGENTS PFIZER PRODUCTS INC. (US) 2004-05-13 WO disclosed
US-20040087571-A1 Methods of using CCR1 antagonists as immunomodulatory agents PFIZER INC 2004-05-06 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-20040087571-A1 Methods of using CCR1 antagonists as immunomodulatory agents CCR1, CCR3, CCRL2 CCR1 1/4885REN 3519/4885LAP3 2885/4885

“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.