SCHEMBL6763019

SCHEMBL6763019

O=C(O)COc1cc(Cl)ccc1OCC(=O)N1[C@@H]2CC[C@H]1CC(Oc1ccc(F)cc1)C2

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 9/20 0.43
PTGDR Q13258 4/20 0.43
PTGER2 P43116 1/20 0.42
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CCR1 P32246 3/20 0.41
EPHX2 P34913 1/20 0.41
FFAR1 O14842 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
MAPT P10636 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL6763023 1.00 PTGDR2 (0.43) PTGDR2PTGDRPTGER2TSHRTDP1
SCHEMBL6758130 0.89 PTGDR2 (0.45) PTGDR2PTGDRTSHRCCR1EPHX2
SCHEMBL6758126 0.89 PTGDR2 (0.45) PTGDR2PTGDRTSHRCCR1EPHX2
SCHEMBL6155923 0.89 CCR1 (0.54) PTGDR2PTGDRTSHRCCR1EPHX2
SCHEMBL6758127 0.89 CCR1 (0.54) PTGDR2PTGDRTSHRCCR1EPHX2
SCHEMBL6155917 0.89 CCR1 (0.54) PTGDR2PTGDRTSHRCCR1EPHX2
SCHEMBL6762010 0.89 CCR1 (0.52) PTGDR2TSHRCCR1EPHX2HTR2C
SCHEMBL6762007 0.89 CCR1 (0.52) PTGDR2TSHRCCR1EPHX2HTR2C
SCHEMBL6758359 0.88 TSHR (0.43) PTGDR2TSHRCCR1EPHX2MAPT
SCHEMBL6758352 0.88 TSHR (0.43) PTGDR2TSHRCCR1EPHX2MAPT

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 PTGDR2 628/4885PTGDR 400/4885PTGER2 819/4885

“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.