SCHEMBL6158558

SCHEMBL6158558

NC(=O)Cc1cc(Cl)ccc1OCC(=O)N1[C@@H]2CC[C@@H]1CC(Oc1ccc(F)cc1)C2

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 6/20 0.45
PTGDR2 Q9Y5Y4 3/20 0.42
EPHX2 P34913 2/20 0.42
TSHR P16473 1/20 0.40
OPRK1 P41145 3/20 0.38
KCNH2 Q12809 3/20 0.38
OPRM1 P35372 2/20 0.38
FPR3 P25089 1/20 0.38
GPR65 Q8IYL9 1/20 0.38
GPR35 Q9HC97 1/20 0.38
TP53 P04637 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL6760369 1.00 CCR1 (0.45) CCR1PTGDR2EPHX2TSHROPRK1
SCHEMBL6158565 1.00 CCR1 (0.45) CCR1PTGDR2EPHX2TSHROPRK1
SCHEMBL6758127 0.93 CCR1 (0.54) CCR1PTGDR2EPHX2TSHRMAPT
SCHEMBL6155917 0.93 CCR1 (0.54) CCR1PTGDR2EPHX2TSHRMAPT
SCHEMBL6155923 0.93 CCR1 (0.54) CCR1PTGDR2EPHX2TSHRMAPT
SCHEMBL6765099 0.91 CCR1 (0.41) CCR1PTGDR2EPHX2TSHROPRK1
SCHEMBL6765102 0.91 CCR1 (0.41) CCR1PTGDR2EPHX2TSHROPRK1
SCHEMBL6761272 0.91 EPHX2 (0.43) CCR1PTGDR2EPHX2TSHRTP53
SCHEMBL6761386 0.91 MAPT (0.46) CCR1PTGDR2EPHX2TSHRTP53
SCHEMBL6761269 0.91 EPHX2 (0.43) CCR1PTGDR2EPHX2TSHRTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 US claimed
EP-1525201-A1 BICYCLIC PIPERIDINE DERIVATIVES AS ANTAGONISTS OF THE CCR1 CHEMOKINE RECEPTOR Pfizer Products Inc. (US) 2005-04-27 EP disclosed
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 US disclosed
WO-2004009588-A1 BICYCLIC PIPERIDINE DERIVATIVES AS ANTAGONISTS OF THE CCR1 CHEMOKINE RECEPTOR PFIZER PRODUCTS INC. (US) 2004-01-29 WO 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-20040063688-A1 Novel piperidine derivatives CCR1, CCR3, CCR2 CCR1 1/4885PTGDR2 628/4885EPHX2 3279/4885

“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.