SCHEMBL2682902

SCHEMBL2682902

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 2/20 0.47
PTPN1 P18031 2/20 0.47
PPP1CC P36873 2/20 0.47
PKM P14618 1/20 0.45
FPR2 P25090 8/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.38
FPR3 P25089 4/20 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
SCHEMBL2683926 1.00 PPM1B (0.47) PPM1BPTPN1PPP1CCPKMFPR2
SCHEMBL10224384 1.00 PPM1B (0.47) PPM1BPTPN1PPP1CCPKMFPR2
SCHEMBL2685419 1.00 PPM1B (0.47) PPM1BPTPN1PPP1CCPKMFPR2
SCHEMBL16377662 0.84 PKM (0.39) PPM1BPTPN1PPP1CCPKMFPR2
SCHEMBL16377663 0.81 FPR2 (0.49) PPM1BPTPN1PPP1CCPKMFPR2
SCHEMBL855772 0.81 FPR2 (0.49) PPM1BPTPN1PPP1CCPKMFPR2
SCHEMBL856527 0.80 FPR2 (0.56) PKMFPR2SMN1; SMN2ALDH1A1POLB
SCHEMBL8547143 0.80 FPR2 (0.56) PKMFPR2SMN1; SMN2ALDH1A1POLB
SCHEMBL855208 0.77 SMN1; SMN2 (0.37) PKMFPR2SMN1; SMN2FPR3
SCHEMBL2683203 0.77 SMN1; SMN2 (0.37) PKMFPR2SMN1; SMN2FPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 (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-20120115841-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS FPR1, FPR2, FPR3 PPM1B 4312/4885PTPN1 2506/4885PPP1CC 4803/4885

“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.