SCHEMBL2312942

SCHEMBL2312942

COC(=O)C1(c2ccc(C(N)=O)cc2)CCC(=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.43
▸ PDE4B Q07343 1/20 0.43
▸ PDE4C Q08493 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ PARP10 Q53GL7 5/20 0.41
▸ PARP4 Q9UKK3 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA1 P00915 1/20 0.41
▸ PARP1 P09874 1/20 0.41
▸ PARP2 Q9UGN5 1/20 0.41
▸ KCNA3 P22001 2/20 0.41
▸ KMT2A Q03164 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ PARP15 Q460N3 1/20 0.36
▸ PARP14 Q460N5 1/20 0.36
▸ PARP16 Q8N5Y8 1/20 0.36
▸ PARP11 Q9NR21 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35

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
SCHEMBL6070228 0.89 PARP10 (0.47) PARP10PARP4CA2CA1PARP1
SCHEMBL16897591 0.83 OPRM1 (0.47) PDE4APDE4BPDE4CPDE4DKCNA3
SCHEMBL15348097 0.82 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DKCNA3
SCHEMBL16287573 0.82 KCNA3 (0.48) PDE4APDE4BPDE4CPDE4DKCNA3
SCHEMBL11047897 0.82 OPRM1 (0.47) PDE4APDE4BPDE4CPDE4DKCNA3
SCHEMBL5765569 0.81 MEN1 (0.50) KCNA3KMT2AHSD11B1MEN1OPRM1
SCHEMBL195327 0.78 THRB (0.44) PDE4APDE4BPDE4CPDE4DKCNA3
SCHEMBL1018912 0.74 POLB (0.49) CA2CA1KCNA3KMT2AALDH1A1
SCHEMBL613788 0.74 PARP10 (0.40) PARP10PARP4CA2CA1PARP1
SCHEMBL16137494 0.74 MEN1 (0.47) KCNA3KMT2AHSD11B1MEN1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039474-B2 2,3,4,9-tetrahydro-1H-carbazole derivatives as CRTH2 receptor antagonists ACTELION PHARMACEUTICAL LTD. (CH) 2011-10-18 — — US disclosed
EP-1833791-B1 2,3,4,9-TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-08-03 — — EP disclosed
US-20090270414-A1 2,3,4,9- TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2009-10-29 — — US disclosed
EP-1833791-A2 2,3,4,9-TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2007-09-19 — — EP disclosed
WO-2006070325-A2 2,3,4,9-TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2006-07-06 — — 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 (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-20090270414-A1 2,3,4,9- TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS HRH2, CRHR2, GRK2 PDE4A 680/4885PDE4B 486/4885PDE4C 1104/4885

“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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