SCHEMBL4923374

SCHEMBL4923374

CC(O)c1cnncc1C(=O)NCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
HPGD P15428 3/20 0.49
GAA P10253 2/20 0.49
TP53 P04637 1/20 0.49
GLA P06280 1/20 0.49
LMNA P02545 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
METAP2 P50579 1/20 0.48
CHRNB2 P17787 1/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA4 P43681 1/20 0.48
APEX1 P27695 1/20 0.48
HTT P42858 1/20 0.47
NR3C1 P04150 1/20 0.46
USP2 O75604 1/20 0.46

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
SCHEMBL27687948 0.77 LMNA (0.55) KMT2AHPGDGAATP53GLA
SCHEMBL27021656 0.76 KMT2A (0.65) KMT2AHPGDGAATP53GLA
SCHEMBL5216952 0.73 HPGD (0.57) KMT2AHPGDGAATP53GLA
SCHEMBL19912629 0.73 KMT2A (0.65) KMT2AHPGDGAATP53GLA
SCHEMBL11901003 0.73 KMT2A (0.89) KMT2AHPGDGAATP53GLA
SCHEMBL31680569 0.73 KMT2A (0.89) KMT2AHPGDGAATP53GLA
SCHEMBL12141968 0.70 NSD2 (0.63) KMT2AHPGDGAATP53GLA
SCHEMBL27342359 0.70 KMT2A (0.56) KMT2AHPGDGAATP53GLA
SCHEMBL11192370 0.69 MAPK14 (0.59) KMT2AHPGDGAASMN1; SMN2NR3C1
SCHEMBL21644655 0.69 HSP90AA1 (0.64) KMT2AHPGDGAATP53GLA

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-20080214552-A1 Substituted Pyridazinecarboxamides and Derivatives Thereof BAYER CROPSCIENCE AG (DE) 2008-09-04 US disclosed
EP-1763303-A1 SUBSTITUTED PYRIDAZINE CARBOXAMIDES AND DERIVATIVES THEREOF Bayer CropScience Aktiengesellschaft (DE) 2007-03-21 EP disclosed
WO-2006000333-A1 SUBSTITUTED PYRIDAZINE CARBOXAMIDES AND DERIVATIVES THEREOF BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2006-01-05 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-20080214552-A1 Substituted Pyridazinecarboxamides and Derivatives Thereof PFAS, CYP4Z1, CYP4F12 KMT2A 1713/4885HPGD 1046/4885GAA 1989/4885

“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.