SCHEMBL856527

SCHEMBL856527

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

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 13/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 1/20 0.56
PKM P14618 1/20 0.50
POLB P06746 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
APEX1 P27695 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.39
FPR3 P25089 6/20 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
SCHEMBL8547143 1.00 FPR2 (0.56) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL17922785 0.89 FPR2 (0.49) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL855772 0.84 FPR2 (0.49) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL16377663 0.84 FPR2 (0.49) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL2685419 0.80 PPM1B (0.47) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL2682902 0.80 PPM1B (0.47) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL10224384 0.80 PPM1B (0.47) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL2683926 0.80 PPM1B (0.47) FPR2SMN1; SMN2ALDH1A1PKMPOLB
SCHEMBL856243 0.78 FPR2 (0.57) FPR2SMN1; SMN2ALDH1A1PKMFPR3
SCHEMBL727476 0.78 FPR2 (0.77) FPR2SMN1; SMN2ALDH1A1PKMFPR3

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676761-B2 Difluoroethyl-oxazole substituted bridged spiro[2.4]heptane derivatives as ALX receptor agonists ACTELION PHARMACEUTICALS, LTD. (CH) 2017-06-13 US disclosed
EP-3022188-B1 PIPERAZINE SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2017-06-07 EP disclosed
EP-3013817-B1 DIFLUOROETHYL-OXAZOLE SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2017-04-26 EP disclosed
US-9533964-B2 Piperazine substituted bridged spiro[2.4]heptane derivatives as ALX receptor agonists ACTELION PHARMACEUTICALS LTD. (CH) 2017-01-03 US disclosed
US-20160289221-A1 Difluoroethyl-oxazole sustituted bridged spiro[2.4]heptane derivatives as alx receptor agonists IDORSIA PHARMACEUTICALS LTD (CH) 2016-10-06 US disclosed
EP-2850060-B1 FLUORINATED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2016-07-13 EP disclosed
EP-2850058-B1 1-(P-TOLYL)CYCLOPROPYL SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2016-07-13 EP disclosed
US-20160152584-A1 PIPERAZINE SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS IDORSIA PHARMACEUTICALS LTD (CH) 2016-06-02 US disclosed
EP-3022188-A1 PIPERAZINE SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS Actelion Pharmaceuticals Ltd (CH) 2016-05-25 EP disclosed
EP-3013817-A1 DIFLUOROETHYL-OXAZOLE SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2016-05-04 EP disclosed
WO-2013171694-A1 FLUORINATED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2013-11-21 WO disclosed
WO-2013171687-A1 1-(P-TOLYL)CYCLOPROPYL SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2013-11-21 WO 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
EP-2640699-A2 BRIDGED SPIRO[2.4]HEPTANE ESTER DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2013-09-25 EP 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
WO-2012066488-A2 BRIDGED SPIRO[2.4]HEPTANE ESTER DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-05-24 WO 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
EP-2432760-A1 BRIDGED SPIRO [2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-28 EP disclosed
WO-2010134014-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-11-25 WO 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 (4 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 2/4885SMN1; SMN2 3806/4885ALDH1A1 1293/4885
US-20160289221-A1 Difluoroethyl-oxazole sustituted bridged spiro[2.4]heptane derivatives as alx receptor agonists GPR39, P2RX1, P2RX4 FPR2 453/4885SMN1; SMN2 2475/4885ALDH1A1 314/4885
US-20130231319-A1 Bridged Spiro[2.4]heptane Ester Derivatives ADH1A, ADH1C, NAPA FPR2 1944/4885SMN1; SMN2 1193/4885ALDH1A1 609/4885
US-20160152584-A1 PIPERAZINE SUBSTITUTED BRIDGED SPIRO[2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AGONISTS GPR52, P2RX2, HCAR2 FPR2 236/4885SMN1; SMN2 3511/4885ALDH1A1 432/4885

“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.