SCHEMBL6071902

SCHEMBL6071902

CCOC(=O)CNC(=O)Nc1cc(C2=NC(C)(C)Cc3cc(OCC)c4c(c32)CC(C)(C)O4)ccc1C=CC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
NLRP3 Q96P20 2/20 0.33
POLB P06746 2/20 0.33
TSHR P16473 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MLYCD O95822 1/20 0.32
GLA P06280 1/20 0.32
HBB P68871 1/20 0.30
KMT2A Q03164 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL6071891 1.00 KDM4E (0.33) KDM4EALDH1A1NLRP3POLBTSHR
SCHEMBL6071947 0.88 KDM4E (0.42) KDM4EALDH1A1NLRP3POLBTSHR
SCHEMBL6071869 0.85 KDM4E (0.37) KDM4EALDH1A1GLAKMT2A
SCHEMBL6071864 0.85 KDM4E (0.37) KDM4EALDH1A1GLAKMT2A
SCHEMBL6072247 0.85 MAPT (0.40) KDM4EMAPTKMT2AHTT
SCHEMBL6072235 0.85 MAPT (0.40) KDM4EMAPTKMT2AHTT
SCHEMBL6071868 0.84 KDM4E (0.37) KDM4EALDH1A1GLAKMT2A
SCHEMBL6071874 0.84 KDM4E (0.37) KDM4EALDH1A1GLAKMT2A
SCHEMBL6072332 0.83 KDM4E (0.36) KDM4EALDH1A1HSD17B10GLAKMT2A
SCHEMBL6072741 0.83 KDM4E (0.38) KDM4EALDH1A1GLAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060106048-A1 Furoisoquinoline derivative and use thereof PASCALI, PETROS P. (CY) 2006-05-18 US disclosed
EP-1541576-A1 FUROISOQUINOLINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-06-15 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-20060106048-A1 Furoisoquinoline derivative and use thereof PDE3B, PDE2A, PDE3A KDM4E 358/4885ALDH1A1 423/4885NLRP3 2926/4885

“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.