SCHEMBL5784342

SCHEMBL5784342

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

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 4/20 0.32
LMNA P02545 2/20 0.31
SSTR5 P35346 2/20 0.31
PARP1 P09874 1/20 0.31
POLB P06746 2/20 0.31
KMT2A Q03164 2/20 0.31
NPC1 O15118 1/20 0.31
CREBBP Q92793 1/20 0.31
TSHR P16473 1/20 0.31
HBB P68871 1/20 0.31

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
SCHEMBL6072650 0.94 NPC1 (0.32) LMNAKMT2ANPC1CREBBPTSHR
Hydrochloric Acid SCHEMBL5785728 0.94 MRGPRX4 (0.34) IRAK4LMNASSTR5PARP1POLB
SCHEMBL6072421 0.93 NPC1 (0.32) IRAK4LMNAKMT2ANPC1TSHR
Hydrochloric Acid SCHEMBL6071944 0.92 NPC1 (0.33) LMNAPOLBKMT2ANPC1TSHR
SCHEMBL5785059 0.92 KMT2A (0.33) IRAK4LMNASSTR5PARP1POLB
SCHEMBL6072618 0.92 UGCG (0.36) IRAK4LMNAKMT2A
SCHEMBL6072377 0.92 NPC1 (0.31) LMNANPC1
SCHEMBL5785744 0.91 KMT2A (0.33) LMNAPOLBKMT2ANPC1
SCHEMBL6072192 0.91
SCHEMBL5782788 0.90 CREBBP (0.39) IRAK4LMNASSTR5PARP1POLB

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 8 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 claimed
US-6924292-B2 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-02 US claimed
US-20040092582-A1 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-13 US claimed
EP-1270577-A1 FUROISOQUINOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-01-02 EP claimed
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 IRAK4 159/4885LMNA 4533/4885SSTR5 1879/4885

“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.