SCHEMBL5639457

SCHEMBL5639457

O=C(O)N[C@H]1CCCCN(C(=O)Nc2ccc(C(F)(F)F)cc2)C1=O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 18/20 0.53
▸ FPR1 P21462 10/20 0.53
▸ TRPV1 Q8NER1 1/20 0.47

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
SCHEMBL5637096 0.87 ALDH1A1 (0.52) FPR2
SCHEMBL5637813 0.86 RAB9A (0.48) —
SCHEMBL5640321 0.82 FPR1 (0.45) FPR2FPR1TRPV1
SCHEMBL5637671 0.79 NPC1 (0.53) —
SCHEMBL5641964 0.76 FPR2 (0.48) FPR2
SCHEMBL5636798 0.75 PREP (0.33) FPR2FPR1
SCHEMBL5638327 0.75 NPC1 (0.44) FPR2FPR1
SCHEMBL28884238 0.74 NAMPT (0.51) FPR2FPR1TRPV1
SCHEMBL23573367 0.73 EPHX2 (0.64) TRPV1
SCHEMBL5637810 0.73 LMNA (0.40) —

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-7220856-B2 Substituted quinoline CCR5 receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2007-05-22 — — US disclosed
US-20040072818-A1 Substituted quinoline CCR5 receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2004-04-15 — — 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-20040072818-A1 Substituted quinoline CCR5 receptor antagonists CCR5, CXCR3, CCR2 FPR2 180/4885FPR1 107/4885TRPV1 289/4885

“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.

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