SCHEMBL266137

SCHEMBL266137

Cc1c(-c2ccccc2)nn(C)c1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.58
NPSR1 Q6W5P4 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
MAPT P10636 5/20 0.52
LMNA P02545 1/20 0.52
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
GAA P10253 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
CASP1 P29466 1/20 0.45
BRCA1 P38398 1/20 0.45
HTT P42858 1/20 0.45
CASP7 P55210 1/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 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
SCHEMBL28102140 0.82 RECQL (0.42) RECQLNPSR1TDP1SMN1; SMN2MAPT
SCHEMBL14996608 0.80 MAPT (0.47) RECQLNPSR1TDP1SMN1; SMN2MAPT
SCHEMBL10337766 0.80 MAPT (0.51) RECQLTDP1SMN1; SMN2MAPTALDH1A1
SCHEMBL28118093 0.77 MAPT (0.45) RECQLNPSR1TDP1SMN1; SMN2MAPT
SCHEMBL4214390 0.77 MAPT (0.58) RECQLNPSR1SMN1; SMN2MAPTALDH1A1
SCHEMBL17290611 0.77 RECQL (0.46) RECQLNPSR1TDP1SMN1; SMN2MAPT
SCHEMBL16200060 0.77 THRB (0.52) RECQLNPSR1TDP1SMN1; SMN2MAPT
SCHEMBL2076868 0.77 NPSR1 (0.66) RECQLNPSR1TDP1SMN1; SMN2MAPT
SCHEMBL14191068 0.77 NPSR1 (0.66) RECQLNPSR1TDP1SMN1; SMN2MAPT
SCHEMBL2076094 0.75 RECQL (0.53) RECQLNPSR1TDP1SMN1; SMN2MAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629126-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC. (JP) 2014-01-14 US disclosed
US-8629126-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC. (JP) 2014-01-14 US disclosed
US-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2012-05-31 US disclosed
US-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2012-05-31 US disclosed
US-8133882-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC (JP) 2012-03-13 US disclosed
US-8133882-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC (JP) 2012-03-13 US disclosed
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-08-06 US disclosed
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-08-06 US disclosed
EP-1995240-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-26 EP 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 (2 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-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF P2RY10, P2RY12, P2RY11 RECQL 30/4885NPSR1 196/4885TDP1 3740/4885
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF P2RY12, P2RY11, P2RY10 RECQL 62/4885NPSR1 91/4885TDP1 3966/4885

“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.