SCHEMBL16830171

SCHEMBL16830171

Nc1ccc2c(c1)C1(CCC1)C(=O)N2

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PGR P06401 14/20 0.55
PDE4A P27815 4/20 0.51
PDE4B Q07343 4/20 0.51
PDE4C Q08493 4/20 0.51
PDE4D Q08499 4/20 0.51
PDE3B Q13370 4/20 0.51
PDE3A Q14432 4/20 0.51
EPHX2 P34913 1/20 0.46
IP6K1 Q92551 1/20 0.41

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
SCHEMBL20269069 0.97 PGR (0.55) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL12598497 0.95 PGR (0.56) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL22271500 0.93 PGR (0.53) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL5313889 0.84 PGR (0.43) PGRIP6K1
SCHEMBL9375869 0.83 MAPK14 (0.49) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL29622047 0.79 PGR (0.55) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL5499005 0.79 PGR (0.55) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL25399999 0.76 PGR (0.58) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL21912449 0.76 PGR (0.55) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL11641485 0.76 PGR (0.71) PGRPDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10336697-B2 Spiro[cyclobutane-1,3′-indolin]-2′-one derivatives as bromodomain inhibitors ORION CORPORATION (FI) 2019-07-02 US disclosed
US-10336697-B2 Spiro[cyclobutane-1,3′-indolin]-2′-one derivatives as bromodomain inhibitors ORION CORPORATION (FI) 2019-07-02 US disclosed
US-20180186739-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2018-07-05 US disclosed
US-20180186739-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2018-07-05 US disclosed
WO-2018109271-A1 NEW BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2018-06-21 WO disclosed
WO-2018109271-A1 NEW BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2018-06-21 WO disclosed
EP-3310772-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS Orion Corporation (FI) 2018-04-25 EP disclosed
WO-2016203112-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2016-12-22 WO disclosed
WO-2016203112-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2016-12-22 WO disclosed
WO-2015092118-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2015-06-25 WO disclosed
WO-2015092118-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2015-06-25 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 (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-10336697-B2 Spiro[cyclobutane-1,3′-indolin]-2′-one derivatives as bromodomain inhibitors BRD4, BRD3, BRD1 PGR 1184/4885PDE4A 1276/4885PDE4B 1550/4885
US-20180186739-A1 SPIRO[CYCLOBUTANE-1,3'-INDOLIN]-2'-ONE DERIVATIVES AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRD1 PGR 1205/4885PDE4A 1285/4885PDE4B 1548/4885

“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.