SCHEMBL6072196

SCHEMBL6072196

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

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.36
ACLY P53396 3/20 0.36
PTPN1 P18031 4/20 0.33
MRGPRX1 Q96LB2 1/20 0.33
ESRRA P11474 1/20 0.33
WDR5 P61964 1/20 0.32
IDO1 P14902 1/20 0.32
PTPN2 P17706 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RCE1 Q9Y256 1/20 0.31
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 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
SCHEMBL6072310 0.93 HSD17B10 (0.37) HSD17B10PTPN1MRGPRX1ESRRAPTPN2
SCHEMBL6072284 0.90 IDO1 (0.33) ACLYIDO1KDM4EALDH1A1
SCHEMBL6072762 0.89 IDO1 (0.32) ACLYPTPN1IDO1KDM4EALDH1A1
SCHEMBL6071815 0.89 SMN1; SMN2 (0.34) IDO1ALDH1A1
SCHEMBL6072322 0.88 PDE10A (0.32) IDO1
SCHEMBL6072777 0.88 AKR1C3 (0.35) ACLYIDO1KDM4EALDH1A1
SCHEMBL6072447 0.87 IDO1 (0.33) IDO1
SCHEMBL6072191 0.87 ACLY (0.38) ACLYIDO1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6072006 0.86 SSTR5 (0.32) HSD17B10KDM4EALDH1A1
SCHEMBL6072317 0.86 IDO1 (0.31) IDO1

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 HSD17B10 102/4885ACLY 1588/4885PTPN1 2510/4885

“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.