SCHEMBL6072013

SCHEMBL6072013

CCOc1cc2c(c3c1OC(C)(C)C3)C(c1ccc(C(=O)OC)c(NC(=O)Nc3ccccc3)c1)=NC(C)(C)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.40
KMT2A Q03164 6/20 0.38
MAPT P10636 4/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 2/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 3/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PABPC1 P11940 1/20 0.36
POLB P06746 2/20 0.35
TP53 P04637 1/20 0.35
BLM P54132 1/20 0.35
GAA P10253 2/20 0.35
NTRK1 P04629 1/20 0.35
NTRK2 Q16620 1/20 0.35

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
SCHEMBL6072420 0.92 MAPT (0.35) IDO1KMT2AMAPTALDH1A1LMNA
SCHEMBL6071949 0.91 HDAC1 (0.38) KMT2AMAPTALDH1A1MEN1SMN1; SMN2
SCHEMBL6072201 0.90 TDP1 (0.39) IDO1KMT2AMAPTALDH1A1MEN1
SCHEMBL6071890 0.88 POLB (0.36) KMT2AMAPTRAB9ANPC1ALDH1A1
SCHEMBL6071599 0.88 TDP1 (0.32)
SCHEMBL6072285 0.88 MAPT (0.41) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL6071784 0.88 MAPT (0.40) MAPTRAB9ANPC1ALDH1A1LMNA
SCHEMBL6072213 0.87 TDP1 (0.32)
SCHEMBL6072875 0.87 KDM4E (0.36) KMT2AMAPTRAB9ANPC1ALDH1A1
SCHEMBL6072104 0.87 FFAR4 (0.33) IDO1

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 IDO1 1813/4885KMT2A 878/4885MAPT 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.