SCHEMBL6930875

SCHEMBL6930875

CC1CN(C(=O)COc2ccc(Cl)cc2NC(N)=O)[C@@H](C)CN1Cc1ccc(F)cc1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 20/20 0.79
FPR3 P25089 1/20 0.77
GPR65 Q8IYL9 1/20 0.77
GPR35 Q9HC97 1/20 0.77

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
SCHEMBL4587148 1.00 CCR1 (0.79) CCR1FPR3GPR65GPR35
SCHEMBL4587143 1.00 CCR1 (0.79) CCR1FPR3GPR65GPR35
SCHEMBL4586612 1.00 CCR1 (0.79) CCR1FPR3GPR65GPR35
SCHEMBL5972113 1.00 CCR1 (0.79) CCR1FPR3GPR65GPR35
SCHEMBL4588309 0.92 CCR1 (0.78) CCR1FPR3GPR65GPR35
SCHEMBL4588307 0.92 CCR1 (0.78) CCR1FPR3GPR65GPR35
SCHEMBL4588312 0.92 CCR1 (0.78) CCR1FPR3GPR65GPR35
SCHEMBL4588280 0.92 CCR1 (0.75) CCR1FPR3GPR65GPR35
SCHEMBL4588285 0.92 CCR1 (0.75) CCR1FPR3GPR65GPR35
SCHEMBL4588459 0.91 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423166-A2 NON-PEPTIDE CCR1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PROGRESSIVE RENAL FIBROSIS SCHERING AKTIENGESELLSCHAFT (DE) 2004-06-02 EP disclosed
WO-2003013656-A2 NON-PEPTIDE CCR1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PROGRESSIVE RENAL FIBROSIS SCHERING AKTIENGESELLSCHAFT (DE) 2003-02-20 WO disclosed