SCHEMBL1074864

SCHEMBL1074864

Cc1ccc(C(=O)c2cn(Cc3ccccc3F)c3ccccc3c2=O)nc1C

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
NOD2 Q9HC29 1/20 0.56
TP53 P04637 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
RXFP1 Q9HBX9 1/20 0.51
ACKR3 P25106 1/20 0.48
CNR2 P34972 2/20 0.47
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.45
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
ALOX12 P18054 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL1549672 0.83 ACKR3 (0.61) MAPTTP53SMN1; SMN2ACKR3CNR2
SCHEMBL1549204 0.82 MAPT (0.66) MAPTNPC1RAB9ANOD2TP53
SCHEMBL1071402 0.82 MAPT (0.63) MAPTNPC1RAB9ANOD2TP53
SCHEMBL1074945 0.81 ACKR3 (0.57) MAPTTP53SMN1; SMN2ACKR3CNR2
SCHEMBL1549166 0.81 MAPT (0.76) MAPTNPC1RAB9ANOD2TP53
SCHEMBL1548743 0.80 ACKR3 (0.58) MAPTTP53SMN1; SMN2ACKR3CNR2
SCHEMBL1081538 0.80 ACKR3 (0.75) MAPTTP53SMN1; SMN2ACKR3CNR2
SCHEMBL13766655 0.80 ACKR3 (0.58) MAPTTP53SMN1; SMN2ACKR3CNR2
SCHEMBL1549755 0.79 MAPT (0.64) MAPTNPC1RAB9ANOD2TP53
SCHEMBL1075828 0.79 NPC1 (0.55) MAPTNPC1RAB9ANOD2TP53

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-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
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 MAPT 3753/4885NPC1 937/4885RAB9A 1645/4885

“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.