SCHEMBL1074137

SCHEMBL1074137

O=C1Nc2ccccc2C(=O)C1I

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
PDGFRA P16234 1/20 0.45
FER P16591 1/20 0.45
LTK P29376 1/20 0.45
CDK8 P49336 1/20 0.45
ACVR1 Q04771 1/20 0.45
DYRK1B Q9Y463 1/20 0.45
BRPF1 P55201 1/20 0.41
CREBBP Q92793 1/20 0.41
LMNA P02545 2/20 0.40
GFER P55789 1/20 0.40
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
GSK3B P49841 1/20 0.38
PARP1 P09874 1/20 0.38
MAPT P10636 4/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 3/20 0.37

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
SCHEMBL11451121 0.76 CREBBP (0.50) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL30122758 0.76 MAOA (0.45) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL9393278 0.74 MEN1 (0.59) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL13685637 0.73 MAPT (0.59) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL14375245 0.72 PIM1 (0.60) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL6684295 0.72 MAPT (0.46) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL30556308 0.72 MAOA (0.41) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL9210797 0.71 MAPT (0.45) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL7574131 0.71 MAOA (0.44) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL9206122 0.71 MAPT (0.41) LRRK2MAOAMAOBPDGFRAFER

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 LRRK2 3913/4885MAOA 1184/4885MAOB 550/4885

“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.