SCHEMBL25525580

SCHEMBL25525580

N=C(NC(=O)c1ccc(=O)n(Cc2cccnc2)c1)c1cccc(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.46
BRD4 O60885 2/20 0.46
BRD2 P25440 1/20 0.46
BRD3 Q15059 1/20 0.46
BRDT Q58F21 1/20 0.46
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 3/20 0.42
AGTR1 P30556 1/20 0.41
OPRK1 P41145 1/20 0.41
RAB9A P51151 1/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.40
LMNA P02545 1/20 0.40
GRIN1 Q05586 1/20 0.40

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
SCHEMBL25525579 0.90 BRD4 (0.49) TP53BRD4BRD2BRD3BRDT
SCHEMBL25525585 0.89 MAPT (0.49) TP53BRD4BRD2BRD3BRDT
SCHEMBL25525568 0.89 LMNA (0.51) TP53BRD4BRD2BRD3BRDT
SCHEMBL25525564 0.89 ALDH1A1 (0.53) BRD4BRD2BRD3BRDTCHRNB2
SCHEMBL25525591 0.88 BRD4 (0.57) BRD4BRD2BRD3BRDTALDH1A1
SCHEMBL25525581 0.86 SMN1; SMN2 (0.47) BRD4BRD2BRD3BRDTALDH1A1
SCHEMBL25525582 0.83 BRD4 (0.48) BRD4BRD2BRD3BRDTALDH1A1
SCHEMBL25525592 0.80 BRD4 (0.52) BRD4BRD2BRD3BRDTALDH1A1
SCHEMBL25525565 0.78 MAPT (0.49) TP53BRD4BRD2BRD3BRDT
SCHEMBL25525572 0.77 MAPT (0.48) TP53BRD4BRD2BRD3BRDT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159513-A1 PYRIDAZINONE COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISEASES EDGEWISE THERAPEUTICS, INC. 2023-05-25 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-20230159513-A1 PYRIDAZINONE COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISEASES IL6, IL1B, IL1RN TP53 4835/4885BRD4 2684/4885BRD2 2550/4885

“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.