SCHEMBL12430705

SCHEMBL12430705

CC1=NN(c2ccc(C)cc2)C(=O)/C1=C/NNC(=O)c1cccc(Br)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
MEN1 O00255 7/20 0.44
KMT2A Q03164 7/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
MAPK1 P28482 2/20 0.44
PSMD14 O00487 1/20 0.44
KAT8 Q9H7Z6 7/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MDM2 Q00987 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
GAA P10253 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL12430722 0.90 KMT2A (0.49) MAPTALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL12857602 0.82 KDM4E (0.53) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL12430715 0.79 KMT2A (0.48) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL14599445 0.78 KMT2A (0.45) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL14599442 0.78 LMNA (0.49) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL12430720 0.78 KMT2A (0.53) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL12510605 0.77 MAPT (0.49) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL14599447 0.75 KMT2A (0.47) MAPTALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL1304495 0.74 KAT8 (0.55) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL12104822 0.74 KAT8 (0.55) MAPTALDH1A1MEN1KMT2AL3MBTL1

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 3 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-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 MAPT 4440/4885ALDH1A1 705/4885SMN1; SMN2 3906/4885

“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.