SCHEMBL12430720

SCHEMBL12430720

CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\NNC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.53
MEN1 O00255 6/20 0.53
MAPT P10636 6/20 0.53
MAPK1 P28482 4/20 0.53
ALDH1A1 P00352 3/20 0.53
HTT P42858 3/20 0.53
NPSR1 Q6W5P4 2/20 0.53
MDM2 Q00987 1/20 0.53
GPR55 Q9Y2T6 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.48
POLB P06746 3/20 0.48
NSD2 O96028 1/20 0.48
HSPA1A P0DMV8 1/20 0.48
TNNI3 P19429 1/20 0.48
GRK2 P25098 1/20 0.48
DNMT1 P26358 1/20 0.48
TNNT2 P45379 1/20 0.48
TNNC1 P63316 1/20 0.48
MCL1 Q07820 1/20 0.48
KAT8 Q9H7Z6 3/20 0.48

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
SCHEMBL12857602 0.90 KDM4E (0.53) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL14599446 0.84 EP300 (0.43) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL12430709 0.83 EP300 (0.43) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL14629657 0.83 MEN1 (0.46) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL12430715 0.82 KMT2A (0.48) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL14599442 0.81 LMNA (0.49) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL9524504 0.81 KMT2A (0.55) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL12430722 0.81 KMT2A (0.49) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL14599445 0.79 KMT2A (0.45) KMT2AMEN1MAPTMAPK1ALDH1A1
SCHEMBL12430705 0.78 MAPT (0.45) KMT2AMEN1MAPTMAPK1ALDH1A1

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
US-7977366-B2 Treating an inflammatory disorder or inhibiting respiratory burst in adherent neutrophils with chemical inhibitors of neutrophil activation CORNELL RESEARCH FOUNDATION, INC. (US) 2011-07-12 US disclosed
US-7977366-B2 Treating an inflammatory disorder or inhibiting respiratory burst in adherent neutrophils with chemical inhibitors of neutrophil activation CORNELL RESEARCH FOUNDATION, INC. (US) 2011-07-12 US disclosed
US-20070021448-A1 Treating an inflammatory disorder or inhibiting respiratory burst in adherent neutrophils with chemical inhibitors of neutrophil activation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-01-25 US disclosed
US-20070021448-A1 Treating an inflammatory disorder or inhibiting respiratory burst in adherent neutrophils with chemical inhibitors of neutrophil activation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-01-25 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-20070021448-A1 Treating an inflammatory disorder or inhibiting respiratory burst in adherent neutrophils with chemical inhibitors of neutrophil activation MPO, MMP8, SERPINB1 KMT2A 4421/4885MEN1 4710/4885MAPT 4440/4885

“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.