SCHEMBL6765113

SCHEMBL6765113

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

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
EPHX2 P34913 1/20 0.40
P2RX4 Q99571 3/20 0.40
NAAA Q02083 1/20 0.39
CCR1 P32246 5/20 0.39
OPRK1 P41145 3/20 0.38
KCNH2 Q12809 3/20 0.38
OPRM1 P35372 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
FPR3 P25089 1/20 0.37
GPR65 Q8IYL9 1/20 0.37
GPR35 Q9HC97 1/20 0.37
TP53 P04637 1/20 0.36
SCN9A Q15858 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
SCHEMBL6765115 1.00 TSHR (0.40) TSHREPHX2P2RX4NAAACCR1
SCHEMBL6758359 0.89 TSHR (0.43) TSHREPHX2NAAACCR1LMNA
SCHEMBL6758352 0.89 TSHR (0.43) TSHREPHX2NAAACCR1LMNA
SCHEMBL6761243 0.88 CCR1 (0.46) TSHREPHX2NAAACCR1OPRK1
SCHEMBL6761239 0.88 CCR1 (0.46) TSHREPHX2NAAACCR1OPRK1
SCHEMBL6156266 0.86 CCR1 (0.43) TSHREPHX2CCR1OPRK1KCNH2
SCHEMBL6156258 0.86 CCR1 (0.43) TSHREPHX2CCR1OPRK1KCNH2
SCHEMBL6758368 0.86 CCR1 (0.43) TSHREPHX2CCR1OPRK1KCNH2
SCHEMBL6762686 0.85 CCR1 (0.55) TSHREPHX2NAAACCR1LMNA
SCHEMBL6762690 0.85 CCR1 (0.55) TSHREPHX2NAAACCR1LMNA

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 TSHR 2865/4885EPHX2 3279/4885P2RX4 492/4885

“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.