SCHEMBL1022142

SCHEMBL1022142

Cc1ccc2c(=O)c(C(=O)c3ccc(C)c(C)c3)cn(Cc3cccc(Br)n3)c2n1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.73
MAPT P10636 8/20 0.59
TP53 P04637 4/20 0.59
TDP1 Q9NUW8 1/20 0.52
RXFP1 Q9HBX9 7/20 0.52
THRB P10828 2/20 0.52
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL1074620 0.92 MAPT (0.63) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL1073114 0.90 ACKR3 (0.60) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL1022141 0.90 ACKR3 (0.75) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL1075564 0.89 ACKR3 (0.58) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL12707220 0.89 MAPT (0.59) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL1074330 0.86 MAPT (0.58) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL1020308 0.85 LMNA (0.64) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL1072311 0.85 ACKR3 (0.73) ACKR3MAPTTP53TDP1RXFP1
SCHEMBL1074089 0.85 ACKR3 (1.00) ACKR3MAPTTP53POLB
SCHEMBL1072893 0.84 ACKR3 (0.72) ACKR3MAPTTP53TDP1THRB

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 13 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
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 3624/4885MAPT 3753/4885TP53 40/4885

“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.