SCHEMBL6596973

SCHEMBL6596973

N#Cc1cc(Br)ccc1N[C]=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.36
MAOA P21397 2/20 0.36
CHEK1 O14757 1/20 0.34
SLC1A5 Q15758 1/20 0.33
MCL1 Q07820 1/20 0.33
PTGFR P43088 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 2/20 0.32
SRC P12931 1/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
PKM P14618 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL6596979 0.78 MAOB (0.36) MAOBMAOACHEK1SLC1A5MCL1
SCHEMBL30336388 0.77 SRC (0.39) MAOBMAOACHEK1SLC1A5PTGFR
SCHEMBL13174924 0.77 SRC (0.39) MAOBMAOACHEK1SLC1A5PTGFR
SCHEMBL28311211 0.76 MAOB (0.35) MAOBMAOACHEK1SLC1A5MCL1
SCHEMBL10465697 0.76 HSP90AA1 (0.41) MCL1SMN1; SMN2GAAMEN1ALDH1A1
SCHEMBL2422717 0.74 KIF11 (0.56) MAOBMAOA
SCHEMBL7523466 0.73 SIGMAR1 (0.44) GAAMEN1ALDH1A1KMT2ALMNA
SCHEMBL7531861 0.73 MAPK1 (0.46) SMN1; SMN2GAAMEN1ALDH1A1KMT2A
SCHEMBL4726375 0.73 LMNA (0.46) SMN1; SMN2GAAMEN1ALDH1A1KMT2A
SCHEMBL15485828 0.73 RECQL (0.36) MAOBMAOASLC1A5PTGFRSMN1; SMN2

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
EP-1063235-B1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LTD (JP) 2004-05-12 EP disclosed
US-20030186976-A1 Benzofurylpyrone derivatives TEIJIN LIMITED, MICROBIAL CHEMISTRY RESEARCH FOUNDATION 2003-10-02 US disclosed
US-6589984-B1 Blood cholesterol and triglycerides (TG) themselves are generally insoluble in blood, and they exist as lipoproteins by binding with apolipoproteins. In the body, triglycerides are biosynthesized primarily in the liver from acetyl CoA as TEIJIN LIMITED (JP) 2003-07-08 US disclosed
EP-1063235-A1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LIMITED (JP) 2000-12-27 EP 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-20030186976-A1 Benzofurylpyrone derivatives PLIN5, ACSL5, PLIN1 MAOB 3367/4885MAOA 4187/4885CHEK1 2898/4885

“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.