SCHEMBL6835947

SCHEMBL6835947

CC1CN(C(=O)COc2ccc(Cl)cc2NC(=O)NCCN)C(C)CN1Cc1ccc(F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 20/20 1.00
FPR3 P25089 1/20 0.61
GPR65 Q8IYL9 1/20 0.61
GPR35 Q9HC97 1/20 0.61

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
SCHEMBL6832213 1.00 CCR1 (1.00) CCR1FPR3GPR65GPR35
SCHEMBL6078474 0.91 CCR1 (0.84) CCR1FPR3GPR65GPR35
SCHEMBL5061480 0.91 CCR1 (0.84) CCR1FPR3GPR65GPR35
SCHEMBL5061482 0.91 CCR1 (0.84) CCR1FPR3GPR65GPR35
SCHEMBL5061477 0.91 CCR1 (0.84) CCR1FPR3GPR65GPR35
SCHEMBL6076967 0.90 CCR1 (0.81) CCR1FPR3GPR65GPR35
SCHEMBL5968066 0.89 CCR1 (0.79) CCR1FPR3GPR65GPR35
SCHEMBL4588459 0.89 CCR1 (0.79) CCR1FPR3GPR65GPR35
SCHEMBL4588916 0.89 CCR1 (0.79) CCR1FPR3GPR65GPR35
SCHEMBL4586612 0.88 CCR1 (0.79) CCR1FPR3GPR65GPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058932-A1 Novel piperazine derivatives PFIZER INC. 2004-03-25 US disclosed
US-6649611-B2 Potent and selective inhibitors of chemokine binding to its receptor CCR1 found on inflammatory and immunomodulatory cells (preferably leukocytes and lymphocytes). PFIZER, INC. 2003-11-18 US disclosed
EP-1268455-A2 PIPERAZINE DERIVATIVES Pfizer Products Inc. (US) 2003-01-02 EP disclosed
WO-2001072728-A9 NOVEL PIPERAZINE DERIVATIVES PFIZER PROD INC (US) 2002-10-10 WO disclosed
US-20020107255-A1 Novel piperazine derivatives PFIZER PRODUCTS INC. 2002-08-08 US disclosed
WO-2001072728-A2 NOVEL PIPERAZINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2001-10-04 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 (2 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-20040058932-A1 Novel piperazine derivatives IL5, IL17A, CCR2 CCR1 5/4885FPR3 328/4885GPR65 572/4885
US-20020107255-A1 Novel piperazine derivatives IL5, IL17A, CCR2 CCR1 5/4885FPR3 328/4885GPR65 572/4885

“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.