SCHEMBL5787533

SCHEMBL5787533

CCNc1cccc(C2=NC(C)(C)Cc3cc(OC)c4c(c32)CC(C)(C)O4)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.34
LMNA P02545 3/20 0.34
TP53 P04637 2/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HTT P42858 1/20 0.33
SLC2A1 P11166 1/20 0.32
FFAR4 Q5NUL3 3/20 0.32
KMT2A Q03164 1/20 0.31
PDE4D Q08499 1/20 0.31
MAPT P10636 1/20 0.31
NTSR1 P30989 1/20 0.31
GLA P06280 1/20 0.30
NR3C1 P04150 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
SCHEMBL5784191 0.91 KDM4E (0.35) KDM4ELMNATP53HPGDSMN1; SMN2
SCHEMBL5784813 0.89 KDM4E (0.36) KDM4ELMNATP53HPGDSMN1; SMN2
SCHEMBL5785185 0.86 BRD4 (0.38) KDM4ELMNATP53ALDH1A1KMT2A
SCHEMBL5784127 0.86 POLB (0.40) SMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL5784402 0.85 IDO1 (0.37) KDM4ELMNATP53HPGDSMN1; SMN2
SCHEMBL5785105 0.85 LMNA (0.35) KDM4ELMNATP53HPGDSMN1; SMN2
SCHEMBL5784369 0.85 LMNA (0.34) KDM4ELMNATP53HPGDSMN1; SMN2
SCHEMBL5787614 0.85 KDM4E (0.38) KDM4ELMNATP53HPGDSMN1; SMN2
SCHEMBL5786230 0.85 LMNA (0.38) LMNASMN1; SMN2ALDH1A1HTTKMT2A
SCHEMBL5785757 0.85 KDM4E (0.41) KDM4ELMNATP53HPGDSMN1; 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 KDM4E 300/4885LMNA 4533/4885TP53 3833/4885

“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.