SCHEMBL5783309

SCHEMBL5783309

CCOc1cc2c(c3c1OC(C)(C)C3)C(c1cccc(NC(=O)CSC)c1)=NC(C)(C)C2

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
POLB P06746 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 3/20 0.35
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
TSHR P16473 1/20 0.34
HBB P68871 1/20 0.34
CHKA P35790 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34

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
SCHEMBL5787677 0.92 LMNA (0.37) LMNAPOLBKMT2AMAPTALDH1A1
SCHEMBL5786654 0.91 LMNA (0.39) LMNAPOLBKMT2AMAPTALDH1A1
SCHEMBL6072366 0.89 LMNA (0.36) LMNAPOLBKMT2AMAPTALDH1A1
SCHEMBL5787539 0.88 LMNA (0.37) LMNAPOLBKMT2AMAPTALDH1A1
SCHEMBL6072505 0.87 IRAK4 (0.36) LMNAPOLBKMT2AMAPTALDH1A1
SCHEMBL6072152 0.86 POLB (0.34) LMNAPOLBKMT2AMAPTALDH1A1
SCHEMBL6072391 0.85 KMT2A (0.41) LMNAPOLBKMT2AMAPTALDH1A1
SCHEMBL5784815 0.84 LMNA (0.36) LMNAPOLBKMT2AMAPTALDH1A1
Acetic Acid SCHEMBL6072471 0.83 MAPT (0.39) LMNAKMT2AMAPTALDH1A1HPGD
SCHEMBL5784799 0.83 DHFR (0.40) LMNAKMT2AALDH1A1TSHRSMN1; 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-1270577-B1 FUROISOQUINOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2006-12-06 EP disclosed
US-6924292-B2 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-02 US disclosed
US-20040092582-A1 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-13 US disclosed
EP-1270577-A1 FUROISOQUINOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-01-02 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-20040092582-A1 Furoisoquinoline derivatives, process for producing the same and use thereof PDE3B, PDE5A, PDE3A LMNA 4533/4885POLB 1153/4885KMT2A 1140/4885

“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.