SCHEMBL6005207

SCHEMBL6005207

S=CNCN1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 1/20 0.34
CXCR4 P61073 2/20 0.33
SIGMAR1 Q99720 4/20 0.32
CHRM5 P08912 2/20 0.32
CHRM3 P20309 2/20 0.32
RAD52 P43351 1/20 0.32

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
SCHEMBL6008543 0.87
SCHEMBL6008504 0.78
SCHEMBL6007445 0.77 CHRM5 (0.36) HSD17B10SMN1; SMN2POLBCXCR4SIGMAR1
SCHEMBL6005146 0.76 HRH3 (0.35) SMN1; SMN2SIGMAR1CHRM5
SCHEMBL16260719 0.72 POLB (0.41) HSD17B10SMN1; SMN2POLBCXCR4SIGMAR1
SCHEMBL6005179 0.70
SCHEMBL4107640 0.69
SCHEMBL15329094 0.68 HSD17B10 (0.57) HSD17B10SMN1; SMN2POLBCXCR4SIGMAR1
SCHEMBL6005200 0.68 HSD17B10 (0.42) HSD17B10SMN1; SMN2POLBCXCR4SIGMAR1
SCHEMBL6005193 0.65

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1207161-B1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2006-01-18 EP disclosed
US-6777410-B2 SUCH AS 9-(2-METHOXYPHENYL)-3-(1-METHYLETHYL)-(1,3)OXAZOLO-(2,3)ISOINDOLE-2,5(3H,9H)-DIONE; DIABETES AND COMPLICATIONS; OBESITY BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-08-17 US disclosed
US-20040053923-A1 Novel isoindole derivatives BANYU PHARMACEUTICAL CO., LTD. 2004-03-18 US disclosed
US-6608098-B1 Diabetes or obesity, 2-(4-(3-isopropyl-2,5-dioxo-2,3-dihydro-1H-pyrrolo(2,1-a) isoindol-9(5H)-yl)phenoxy)-N-propylacetamide BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-08-19 US disclosed
EP-1207161-A1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-05-22 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-20040053923-A1 Novel isoindole derivatives GPR119, SLC5A2, SLC5A1 HSD17B10 418/4885SMN1; SMN2 4010/4885POLB 4662/4885

“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.