SCHEMBL6071593

SCHEMBL6071593

CCOC(=O)CNC(=O)c1ccc(C2=NC(C)(C)Cc3cc(OCC)c4c(c32)CC(C)(C)O4)cc1N

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
BRCA1 P38398 1/20 0.34
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CASP1 P29466 2/20 0.32
EZH2 Q15910 1/20 0.32
KMT2A Q03164 2/20 0.32
TSHR P16473 2/20 0.32
HBB P68871 1/20 0.32
NPC1 O15118 2/20 0.31
GLA P06280 2/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
IRAK4 Q9NWZ3 2/20 0.31
HPGD P15428 3/20 0.31
PKM P14618 1/20 0.31
KDM4E B2RXH2 2/20 0.31
HSD17B10 Q99714 2/20 0.31
CASP7 P55210 1/20 0.31
POLB P06746 2/20 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
SCHEMBL6072134 0.90 IRAK4 (0.32) EZH2IRAK4
SCHEMBL6071475 0.88 NPC1 (0.39) ALDH1A1MAPTSMN1; SMN2KMT2ATSHR
SCHEMBL6072245 0.88 JAK2 (0.31) IRAK4
SCHEMBL6071942 0.87 CXCR2 (0.31) IRAK4
SCHEMBL6071808 0.87 GAA (0.33) ALDH1A1MAPTCASP1EZH2TSHR
SCHEMBL6072290 0.87 PPID (0.36) ALDH1A1BRCA1MAPTEZH2KMT2A
SCHEMBL6072319 0.87 HTT (0.36) ALDH1A1MAPTSMN1; SMN2KMT2ATP53
SCHEMBL6072110 0.86 CASP1 (0.35) ALDH1A1BRCA1MAPTCASP1EZH2
SCHEMBL6072318 0.86 ALDH1A1 (0.33) ALDH1A1BRCA1MAPTSMN1; SMN2
SCHEMBL6072324 0.86 ALDH1A1 (0.33) ALDH1A1BRCA1MAPTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060222887-A1 Organic electroluminescent device FUJI PHOTO FILM CO., LTD. 2006-10-05 US disclosed
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 ALDH1A1 423/4885BRCA1 4600/4885MAPT 4861/4885

“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.