SCHEMBL1083479

SCHEMBL1083479

N#Cc1cccc(Cn2cc(C(=O)c3ccc4c(c3)OCCO4)c(=O)c3ccccc32)n1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.48
RXFP1 Q9HBX9 1/20 0.48
MAPT P10636 6/20 0.47
TP53 P04637 5/20 0.46
PRNP P04156 1/20 0.45
POLB P06746 3/20 0.43
CNR2 P34972 1/20 0.43
THRB P10828 1/20 0.42

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
SCHEMBL1083101 0.86 ACKR3 (0.61) ACKR3SMN1; SMN2RXFP1MAPTTP53
SCHEMBL1550468 0.86 ACKR3 (0.72) ACKR3SMN1; SMN2RXFP1MAPTTP53
SCHEMBL1072088 0.86 ACKR3 (0.57) ACKR3SMN1; SMN2RXFP1MAPTTP53
SCHEMBL1023539 0.85 ACKR3 (0.75) ACKR3SMN1; SMN2MAPTTP53POLB
SCHEMBL1073965 0.84 ACKR3 (0.54) ACKR3SMN1; SMN2RXFP1MAPTTP53
SCHEMBL1022303 0.81 ACKR3 (0.62) ACKR3SMN1; SMN2MAPTTP53POLB
SCHEMBL1073045 0.80 ACKR3 (0.54) ACKR3SMN1; SMN2MAPTTP53POLB
SCHEMBL13762930 0.80 ACKR3 (0.60) ACKR3SMN1; SMN2MAPTTP53POLB
SCHEMBL13762943 0.77 ACKR3 (0.69) ACKR3SMN1; SMN2RXFP1MAPTTP53
SCHEMBL1074524 0.77 SMN1; SMN2 (0.67) SMN1; SMN2RXFP1MAPTTP53PRNP

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 14 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-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
US-7557213-B2 Substituted quinolones and methods of use CHEMOCENTRYX, INC. (US) 2009-07-07 US 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
US-20070167443-A1 Substituted quinolones and methods of use CHEMOCENTRYX, INC. (US) 2007-07-19 US 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
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 ACKR3 3624/4885SMN1; SMN2 2712/4885RXFP1 4610/4885

“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.