SCHEMBL6995002

SCHEMBL6995002

NC(=O)CNC(=O)Nc1cc(Cl)cnc1OCC(=O)N1C2CCC1CN(Cc1ccc(F)cc1)C2

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 16/20 0.44
FPR3 P25089 1/20 0.42
GPR65 Q8IYL9 1/20 0.42
GPR35 Q9HC97 1/20 0.42
CCR3 P51677 1/20 0.37
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
KCNK3 O14649 1/20 0.35
KCNK9 Q9NPC2 1/20 0.35

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
SCHEMBL7002094 0.88 CCR1 (0.47) CCR1FPR3GPR65GPR35KCNK3
SCHEMBL7004493 0.87 PTGER4 (0.43) CCR1FPR3GPR65GPR35PTGDR2
SCHEMBL6996220 0.82 CCR1 (0.43) CCR1FPR3GPR65GPR35PTGDR2
SCHEMBL7001642 0.79 GRM2 (0.41) CCR1FPR3GPR65GPR35
SCHEMBL6999918 0.79 CCR1 (0.40) CCR1FPR3GPR65GPR35PTGDR2
SCHEMBL6999003 0.77 CCR1 (0.41) CCR1FPR3GPR65GPR35
SCHEMBL7004496 0.77 CCR1 (0.41) CCR1FPR3GPR65GPR35PTGDR2
SCHEMBL6763101 0.75 CCR1 (0.40) CCR1FPR3GPR65GPR35
SCHEMBL6763114 0.75 CCR1 (0.40) CCR1FPR3GPR65GPR35
SCHEMBL7001654 0.74 CCR1 (0.38) 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-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