SCHEMBL6594846

SCHEMBL6594846

Cc1c(-c2cc3cc(OCCN4CCCC4)ccc3o2)oc(=O)c(C)c1O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.49
MAOA P21397 1/20 0.49
CCR4 P51679 2/20 0.48
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
SIGMAR1 Q99720 3/20 0.45
ADAM17 P78536 3/20 0.45
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
TSHR P16473 1/20 0.44
APP P05067 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
KDM4E B2RXH2 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
SCHEMBL6594236 0.92 CCR4 (0.49) CCR4BCHEACHESIGMAR1KDM4E
SCHEMBL6596054 0.92 MAOB (0.56) MAOBMAOACCR4BCHEACHE
SCHEMBL6592926 0.85 CCR4 (0.52) MAOBMAOACCR4BCHEACHE
SCHEMBL6596608 0.83 ACHE (0.42) MAOBMAOAACHESIGMAR1
SCHEMBL6592642 0.82 CHRNB4 (0.45) MAOBMAOA
SCHEMBL6594842 0.82 MKNK1 (0.44) MAOBMAOASIGMAR1
SCHEMBL6590385 0.82 MAOB (0.40) MAOBMAOAAPPKDM4E
SCHEMBL6594015 0.82 NFE2L2 (0.38) MAOBMAOAKDM4E
SCHEMBL6594217 0.81 CA12 (0.40) MAOBMAOAACHEKDM4E
SCHEMBL6593804 0.81 S1PR1 (0.38) MAOBMAOASIGMAR1KDM4E

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
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
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 4187/4885CCR4 2103/4885

“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.