SCHEMBL7144980

SCHEMBL7144980

O=C(O)c1cc(Cl)ccc1OCC(=O)N1C2CCCC1CN(Cc1ccc(F)cc1)C2

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 17/20 0.61
FPR3 P25089 1/20 0.46
GPR65 Q8IYL9 1/20 0.46
GPR35 Q9HC97 1/20 0.46
TSHR P16473 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45
S1PR5 Q9H228 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
SCHEMBL7000591 0.96 CCR1 (0.62) CCR1FPR3GPR65GPR35TSHR
SCHEMBL7002150 0.92 CCR1 (0.51) CCR1FPR3GPR65GPR35TSHR
SCHEMBL7000018 0.89 CCR1 (0.53) CCR1FPR3GPR65GPR35PTGDR2
SCHEMBL7146058 0.87 CCR1 (0.62) CCR1FPR3GPR65GPR35TSHR
SCHEMBL6997000 0.82 CCR1 (0.49) CCR1FPR3GPR65GPR35PTGDR2
SCHEMBL7003148 0.82 CCR1 (0.46) CCR1FPR3GPR65GPR35S1PR5
SCHEMBL6993588 0.82 CCR1 (0.48) CCR1FPR3GPR65GPR35TSHR
SCHEMBL6999908 0.81 CCR1 (0.62) CCR1FPR3GPR65GPR35TSHR
SCHEMBL7004433 0.80 CCR1 (0.49) CCR1FPR3GPR65GPR35
SCHEMBL7095156 0.80 CCR1 (0.57) CCR1FPR3GPR65GPR35TSHR

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-1326867-A2 BRIDGED PIPERAZINE DERIVATIVES Pfizer Products Inc. (US) 2003-07-16 EP disclosed
WO-2002032901-A2 BRIDGED PIPERAZINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2002-04-25 WO disclosed