SCHEMBL1549941

SCHEMBL1549941

Cc1cc2c(=O)c(C(=O)C3=COC=C(C4=CC=CCC4)O3)cn(Cc3cccc(Br)n3)c2nc1C

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.43
MAPT P10636 3/20 0.32
TP53 P04637 2/20 0.32

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
SCHEMBL1549327 0.93 MAPT (0.36) ACKR3MAPTTP53
SCHEMBL1074328 0.91 ACKR3 (0.41) ACKR3MAPTTP53
SCHEMBL1550470 0.86 ACKR3 (0.52) ACKR3MAPTTP53
SCHEMBL3374083 0.80 ACKR3 (0.44) ACKR3MAPTTP53
SCHEMBL1072090 0.77 ACKR3 (0.41) ACKR3MAPTTP53
SCHEMBL1083483 0.77 ACKR3 (0.40) ACKR3MAPTTP53
SCHEMBL1073967 0.76 ACKR3 (0.40) ACKR3MAPTTP53
SCHEMBL1022141 0.74 ACKR3 (0.75) ACKR3MAPTTP53
SCHEMBL1549324 0.74 CNR2 (0.43) ACKR3MAPTTP53
SCHEMBL1549940 0.73 ACKR3 (0.59) ACKR3MAPTTP53

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 4 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-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-20070167443-A1 Substituted quinolones and methods of use CHEMOCENTRYX, INC. (US) 2007-07-19 US 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.