SCHEMBL600573

SCHEMBL600573

c1ccc(Nc2ccc3c(N4CCOCC4)nncc3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.53
KDM4E B2RXH2 5/20 0.53
HTT P42858 4/20 0.53
ALDH1A1 P00352 4/20 0.53
HPGD P15428 3/20 0.53
MAPK14 Q16539 3/20 0.49
MAPK1 P28482 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KDM1A O60341 1/20 0.49
TSHR P16473 1/20 0.48
MERTK Q12866 1/20 0.47
MAPT P10636 3/20 0.46
LRRK2 Q5S007 1/20 0.45
HTR2A P28223 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PIK3CA P42336 1/20 0.45
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL22440005 0.80 LMNA (0.63) LMNAKDM4EALDH1A1HPGDMAPK14
SCHEMBL2946003 0.77 MAPK14 (0.49) LMNAKDM4EHTTALDH1A1HPGD
SCHEMBL2954373 0.77 MAPK14 (0.49) LMNAKDM4EALDH1A1MAPK14MAPK1
SCHEMBL600413 0.74 GRM4 (0.45) LMNAHTTALDH1A1MAPK14MAPK1
SCHEMBL30493094 0.71 MAPK14 (0.47) LMNAKDM4EHTTALDH1A1HPGD
SCHEMBL30855000 0.70 KDM1A (0.65) LMNAKDM4EHTTALDH1A1HPGD
SCHEMBL1825303 0.70 LMNA (0.97) LMNAKDM4EHTTALDH1A1HPGD
SCHEMBL2944698 0.70 MAPK14 (0.50) LMNAKDM4EALDH1A1HPGDMAPK14
SCHEMBL22911985 0.68 KMT2A (0.40) LMNAALDH1A1HPGDMAPK14MAPK1
SCHEMBL2948699 0.68 MAPK14 (0.59) ALDH1A1MAPK14MAPK1ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497269-B2 Phthalazine compounds as p38 map kinase modulators and methods of use thereof AMGEN INC. (US) 2013-07-30 US claimed
US-20120040983-A1 Phthalazine Compounds as P38 Map Kinase Modulators and Methods of Use Thereof AMGEN INC. (US) 2012-02-16 US claimed
WO-2010042649-A2 PHTHALAZINE COMPOUNDS AS p38 MAP KINASE MODULATORS AND METHODS OF USE THEREOF AMGEN INC. (US) 2010-04-15 WO claimed
US-8497269-B2 Phthalazine compounds as p38 map kinase modulators and methods of use thereof AMGEN INC. (US) 2013-07-30 US disclosed
US-20120040983-A1 Phthalazine Compounds as P38 Map Kinase Modulators and Methods of Use Thereof AMGEN INC. (US) 2012-02-16 US disclosed
WO-2010042649-A2 PHTHALAZINE COMPOUNDS AS p38 MAP KINASE MODULATORS AND METHODS OF USE THEREOF AMGEN INC. (US) 2010-04-15 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-20120040983-A1 Phthalazine Compounds as P38 Map Kinase Modulators and Methods of Use Thereof MAPK1, MAPK4, MAPK12 LMNA 4011/4885KDM4E 3000/4885HTT 3924/4885

“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.