SCHEMBL6071922

SCHEMBL6071922

CCOc1cc2c(c3c1OC(C)(C)C3)C(c1ccc(C(=O)OC)c(NC(=O)c3cccnc3)c1)=NC(C)(C)C2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
LMNA P02545 5/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
TP53 P04637 2/20 0.41
ABCG2 Q9UNQ0 2/20 0.40
PKM P14618 2/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.37
HDAC1 Q13547 2/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ABCB1 P08183 1/20 0.36

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
SCHEMBL6072017 0.94 KDM4E (0.44) KDM4ELMNACYP1A2CYP3A4TP53
SCHEMBL6071949 0.92 HDAC1 (0.38) KDM4ETP53ALDH1A1GAAHDAC1
SCHEMBL6071789 0.92 GAA (0.35) KDM4ELMNACYP1A2CYP3A4ABCG2
SCHEMBL6072462 0.91 KDM4E (0.41) KDM4ELMNACYP1A2CYP3A4TP53
SCHEMBL6072312 0.90 KDM4E (0.40) KDM4ELMNACYP1A2CYP3A4TP53
SCHEMBL6072311 0.88 ABCG2 (0.36) KDM4ELMNATP53ABCG2ALDH1A1
SCHEMBL6072606 0.88 ABCG2 (0.35) TP53ABCG2MAPTABCB1
SCHEMBL6072285 0.88 MAPT (0.41) KDM4ELMNAABCG2GAAMAPT
SCHEMBL6071856 0.88 CREBBP (0.39) LMNAABCG2ALDH1A1HDAC1MAPT
SCHEMBL6072201 0.87 TDP1 (0.39) LMNACYP1A2ALDH1A1MAPTPOLB

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 KDM4E 358/4885LMNA 2455/4885CYP1A2 127/4885

“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.