SCHEMBL1022855

SCHEMBL1022855

COc1cccc(Cn2cc(C(=O)c3ccc(C)c(C)c3)c(=O)c3cc4c(cc32)OCO4)c1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.81
RXFP1 Q9HBX9 2/20 0.75
SMN1; SMN2 Q16637 2/20 0.66
POLB P06746 1/20 0.60
MAPT P10636 6/20 0.59
THRB P10828 1/20 0.58

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
SCHEMBL1073720 0.91 TP53 (0.86) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1021550 0.90 TP53 (0.83) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1074638 0.89 RXFP1 (0.77) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1023375 0.89 TP53 (0.85) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1075310 0.89 TP53 (0.85) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1021521 0.88 RXFP1 (0.75) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL15411596 0.88 MAPT (0.64) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1075648 0.88 TP53 (0.77) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1074878 0.87 TP53 (0.82) TP53RXFP1SMN1; SMN2POLBMAPT
SCHEMBL1074208 0.86 RXFP1 (1.00) TP53RXFP1SMN1; SMN2POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2314590-A1 Substituted quinolones and methods of use ChemoCentryx, Inc. (US) 2011-04-27 EP disclosed
EP-1954274-B8 SUBSTITUTED QUINOLONES AND METHODS OF USE CHEMOCENTRYX INC (US) 2011-01-12 EP disclosed
EP-1954274-B1 SUBSTITUTED QUINOLONES AND METHODS OF USE CHEMOCENTRYX INC (US) 2010-11-03 EP disclosed
US-7557213-B2 Substituted quinolones and methods of use CHEMOCENTRYX, INC. (US) 2009-07-07 US disclosed
EP-1954274-A4 SUBSTITUTED QUINOLONES AND METHODS OF USE CHEMOCENTRYX INC (US) 2009-01-07 EP disclosed
EP-1954274-A2 SUBSTITUTED QUINOLONES AND METHODS OF USE ChemoCentryx Inc (US) 2008-08-13 EP disclosed
US-20070167443-A1 Substituted quinolones and methods of use CHEMOCENTRYX, INC. (US) 2007-07-19 US disclosed
WO-2007059108-A2 SUBSTITUTED QUINOLONES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-24 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-20070167443-A1 Substituted quinolones and methods of use TOP2A, NQO2, TOP2B TP53 40/4885RXFP1 4610/4885SMN1; SMN2 2712/4885

“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.