SCHEMBL6832228

SCHEMBL6832228

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

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.54
LAP3 P28838 4/20 0.52
ANPEP P15144 3/20 0.52
RNPEP Q9H4A4 3/20 0.52
DNPEP Q9ULA0 3/20 0.52
ERAP2 Q6P179 4/20 0.48
ERAP1 Q9NZ08 4/20 0.48
IL1RN P18510 2/20 0.48
CSNK1E P49674 1/20 0.48
LNPEP Q9UIQ6 2/20 0.43
SLC15A1 P46059 1/20 0.43
APP P05067 1/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
SPPL2A Q8TCT8 1/20 0.42

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
SCHEMBL7580246 1.00 CCR1 (0.54) CCR1LAP3ANPEPRNPEPDNPEP
SCHEMBL4065391 0.88 ERAP2 (0.53) CCR1LAP3ANPEPRNPEPDNPEP
SCHEMBL4062972 0.86 SLC1A3 (0.53) CCR1LAP3ANPEPRNPEPDNPEP
SCHEMBL4070006 0.85 CCR1 (0.45) CCR1LAP3ANPEPRNPEPDNPEP
SCHEMBL2675073 0.83 CCR1 (0.57) CCR1LAP3ANPEPRNPEPDNPEP
SCHEMBL4071139 0.82 HTR2A (0.52) CCR1
SCHEMBL4067470 0.82 CCR1 (0.44) CCR1LAP3ANPEPRNPEPDNPEP
SCHEMBL6167499 0.82 CCR1 (0.57) CCR1LAP3ANPEPRNPEPDNPEP
SCHEMBL4061788 0.81 CCR1 (0.46) CCR1ERAP2ERAP1IL1RNLNPEP
SCHEMBL9076303 0.81 CSNK1E (0.64) LAP3ANPEPRNPEPDNPEPCSNK1E

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-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 1/4885LAP3 2885/4885ANPEP 4071/4885

“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.