SCHEMBL6072164

SCHEMBL6072164

CCOc1cc2c(c3c1OC(C)(C)C3)C(c1ccc(C(=O)O)c(NCc3ccc(Cl)cc3)c1)=NC(C)(C)C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 2/20 0.38
KMT2A Q03164 2/20 0.33
SSTR5 P35346 3/20 0.33
MAPT P10636 3/20 0.33
POLB P06746 2/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
PLK1 P53350 1/20 0.32
ALDH1A1 P00352 2/20 0.30
TSHR P16473 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL6072844 0.93 ACLY (0.41) ACLYKMT2AMAPTPOLBLMNA
SCHEMBL6072191 0.93 ACLY (0.38) ACLYKMT2AMAPTPOLBLMNA
SCHEMBL6072661 0.92 ACLY (0.40) ACLYKMT2ASSTR5MAPTALDH1A1
SCHEMBL6072061 0.92 KDM4E (0.40) ACLYKMT2APOLBALDH1A1TSHR
SCHEMBL6071950 0.91 RXRA (0.32) ACLYPLK1ALDH1A1KDM4EGAA
SCHEMBL6072284 0.89 IDO1 (0.33) ACLYKMT2ASSTR5MAPTLMNA
SCHEMBL6072162 0.88 MKNK2 (0.42) MAPTPOLBLMNATHRBCDK2
SCHEMBL6072762 0.88 IDO1 (0.32) ACLYSSTR5MAPTLMNAFFAR4
SCHEMBL6071796 0.88 ALDH1A1 (0.35) ACLYKMT2AMAPTPOLBLMNA
SCHEMBL6071853 0.87 NPSR1 (0.38) KMT2AMAPTPOLBLMNACCNA2

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 ACLY 1588/4885KMT2A 878/4885SSTR5 837/4885

“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.