SCHEMBL5671969

SCHEMBL5671969

NC(=O)Nc1cc(Cl)ccc1OCC(=O)N1CCC(CNCC(=O)O)(Cc2ccc(F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 11/20 0.53
FPR3 P25089 1/20 0.53
GPR65 Q8IYL9 1/20 0.53
GPR35 Q9HC97 1/20 0.53
PTGDR2 Q9Y5Y4 3/20 0.40
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 1/20 0.38
ALOX12 P18054 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL4634971 0.92 CCR1 (0.57) CCR1FPR3GPR65GPR35LMNA
SCHEMBL4634359 0.91 CCR1 (0.54) CCR1FPR3GPR65GPR35LMNA
SCHEMBL5671905 0.91 CCR1 (0.52) CCR1FPR3GPR65GPR35LMNA
SCHEMBL4634270 0.90 CCR1 (0.57) CCR1FPR3GPR65GPR35LMNA
SCHEMBL4634980 0.89 CCR1 (0.59) CCR1FPR3GPR65GPR35LMNA
SCHEMBL4635131 0.89 CCR1 (0.58) CCR1FPR3GPR65GPR35LMNA
SCHEMBL4634727 0.88 CCR1 (0.57) CCR1FPR3GPR65GPR35LMNA
SCHEMBL4635140 0.88 CCR1 (0.57) CCR1FPR3GPR65GPR35LMNA
SCHEMBL4635055 0.87 CCR1 (0.55) CCR1FPR3GPR65GPR35PTGDR2
SCHEMBL4634876 0.87 CCR1 (0.53) CCR1FPR3GPR65GPR35LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060167044-A1 Piperidine derivatives and their use as anti-inflammatory agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-07-27 US 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 (1 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-20060167044-A1 Piperidine derivatives and their use as anti-inflammatory agents CCR1, CCR2, CCR3 CCR1 1/4885FPR3 90/4885GPR65 205/4885

“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.