SCHEMBL2682702

SCHEMBL2682702

O=C(O)[C@H]1[C@H](C(=O)Nc2ccc(Br)cc2)[C@@H]2C=C[C@H]1C21CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 17/20 1.00
ALDH1A1 P00352 1/20 0.76
SMN1; SMN2 Q16637 1/20 0.76
FPR3 P25089 11/20 0.74
FPR1 P21462 1/20 0.67

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
SCHEMBL855215 1.00 FPR2 (1.00) FPR2ALDH1A1SMN1; SMN2FPR3FPR1
SCHEMBL16008361 1.00 FPR2 (1.00) FPR2ALDH1A1SMN1; SMN2FPR3FPR1
SCHEMBL2683879 1.00 FPR2 (1.00) FPR2ALDH1A1SMN1; SMN2FPR3FPR1
SCHEMBL12040526 0.88 FPR2 (1.00) FPR2FPR3
SCHEMBL726966 0.87 FPR2 (0.78) FPR2ALDH1A1SMN1; SMN2FPR3
SCHEMBL727476 0.87 FPR2 (0.77) FPR2ALDH1A1SMN1; SMN2FPR3
SCHEMBL726819 0.86 FPR2 (1.00) FPR2ALDH1A1SMN1; SMN2FPR3
SCHEMBL20013750 0.86 ALDH1A1 (1.00) FPR2ALDH1A1SMN1; SMN2FPR3
SCHEMBL12040473 0.86 FPR2 (0.76) FPR2ALDH1A1SMN1; SMN2FPR3
SCHEMBL2683850 0.85 FPR2 (1.00) FPR2FPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9187435-B2 Bridged Spiro[2.4]heptane ester derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2015-11-17 US disclosed
EP-2640699-B1 BRIDGED SPIRO[2,4]HEPTANE ESTER DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-10-07 EP disclosed
US-8563714-B2 Bridged spiro [2.4] heptane derivatives as ALX receptor and/or FPRL2 agonists ACTELION PHARMACEUTICALS LTD. (CH) 2013-10-22 US disclosed
US-20130231319-A1 Bridged Spiro[2.4]heptane Ester Derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2013-09-05 US disclosed
EP-2432760-B1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2013-07-17 EP disclosed
US-20120115841-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-05-10 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 (2 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-20120115841-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS FPR1, FPR2, FPR3 FPR2 2/4885ALDH1A1 1293/4885SMN1; SMN2 3806/4885
US-20130231319-A1 Bridged Spiro[2.4]heptane Ester Derivatives ADH1A, ADH1C, NAPA FPR2 1944/4885ALDH1A1 609/4885SMN1; SMN2 1193/4885

“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.