SCHEMBL6765196

SCHEMBL6765196

CNC(=O)c1cc(Cl)ccc1OCC(=O)N1[C@@H]2CC[C@H]1CC(Oc1ccc(F)cc1)C2

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.44
TSHR P16473 1/20 0.41
EPHX2 P34913 2/20 0.41
SCN9A Q15858 5/20 0.40
PTGER4 P35408 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.38
FPR3 P25089 1/20 0.37
GPR65 Q8IYL9 1/20 0.37
GPR35 Q9HC97 1/20 0.37
KAT2B Q92831 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL6765200 1.00 CCR1 (0.44) CCR1TSHREPHX2SCN9APTGER4
SCHEMBL6765181 0.90 NPC1 (0.47) CCR1TSHREPHX2NPC1RAB9A
SCHEMBL6765183 0.90 NPC1 (0.47) CCR1TSHREPHX2NPC1RAB9A
SCHEMBL6763128 0.90 CCR1 (0.42) CCR1TSHREPHX2SCN9A
SCHEMBL6763125 0.90 CCR1 (0.42) CCR1TSHREPHX2SCN9A
SCHEMBL6762007 0.89 CCR1 (0.52) CCR1TSHREPHX2PTGER4LMNA
SCHEMBL6762010 0.89 CCR1 (0.52) CCR1TSHREPHX2PTGER4LMNA
SCHEMBL6761308 0.89 CCR1 (0.48) CCR1TSHREPHX2PTGER4NPC1
SCHEMBL6758137 0.89 CCR1 (0.45) CCR1TSHREPHX2PTGER4
SCHEMBL6761312 0.89 CCR1 (0.48) CCR1TSHREPHX2PTGER4NPC1

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
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 US claimed
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 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-20040063688-A1 Novel piperidine derivatives CCR1, CCR3, CCR2 CCR1 1/4885TSHR 2865/4885EPHX2 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.