SCHEMBL7146058

SCHEMBL7146058

O=C(O)Cc1cc(Cl)ccc1OCC(=O)N1C2CCCC1CN(Cc1ccc(F)cc1)C2

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 11/20 0.62
PTGDR2 Q9Y5Y4 8/20 0.53
FPR3 P25089 1/20 0.45
GPR65 Q8IYL9 1/20 0.45
GPR35 Q9HC97 1/20 0.45
TSHR P16473 1/20 0.44

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
SCHEMBL7144980 0.87 CCR1 (0.61) CCR1PTGDR2FPR3GPR65GPR35
SCHEMBL7095156 0.87 CCR1 (0.57) CCR1PTGDR2FPR3GPR65GPR35
SCHEMBL7002150 0.84 CCR1 (0.51) CCR1PTGDR2FPR3GPR65GPR35
SCHEMBL7000591 0.83 CCR1 (0.62) CCR1PTGDR2FPR3GPR65GPR35
SCHEMBL7000018 0.81 CCR1 (0.53) CCR1PTGDR2FPR3GPR65GPR35
SCHEMBL6993588 0.80 CCR1 (0.48) CCR1PTGDR2FPR3GPR65GPR35
SCHEMBL5064429 0.79 PTGDR2 (0.79) CCR1PTGDR2FPR3GPR65GPR35
SCHEMBL6155923 0.79 CCR1 (0.54) CCR1PTGDR2TSHR
SCHEMBL6758127 0.79 CCR1 (0.54) CCR1PTGDR2TSHR
SCHEMBL6155917 0.79 CCR1 (0.54) CCR1PTGDR2TSHR

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