SCHEMBL15280760

SCHEMBL15280760

CC1OC(CO)C(O)C(C)C1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.50
LGALS8 O00214 1/20 0.44
PDE4D Q08499 1/20 0.43
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
TACR2 P21452 1/20 0.40
SLC5A2 P31639 3/20 0.39
PDPK1 O15530 1/20 0.39
MTOR P42345 1/20 0.39
HRAS P01112 1/20 0.39
LGALS3 P17931 1/20 0.38
SLC29A1 Q99808 1/20 0.38

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
SCHEMBL15280784 1.00 SLC6A2 (0.50) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL12585283 1.00 SLC6A2 (0.50) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL18385936 1.00 SLC6A2 (0.50) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL14490090 0.90 SLC6A2 (0.54) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL13775032 0.89 SLC6A2 (0.53) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL19726103 0.89 SLC6A2 (0.47) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL19762885 0.89 SLC6A2 (0.44) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL14413417 0.87 SLC6A2 (0.48) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL10148639 0.87 SLC6A2 (0.57) SLC6A2LGALS8PDE4DTSHRCYP2C19
SCHEMBL19620457 0.87 SLC6A2 (0.48) SLC6A2LGALS8PDE4DTSHRCYP2C19

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
US-9370529-B2 Tannin inhibitors of HIV UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2016-06-21 US disclosed
US-20160038520-A1 TANNIN INHIBITORS OF HIV NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2016-02-11 US disclosed
US-9181291-B2 Tannin inhibitors of HIV UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2015-11-10 US disclosed
US-20130252909-A1 TANNIN INHIBITORS OF HIV UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2013-09-26 US 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 (2 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-20130252909-A1 TANNIN INHIBITORS OF HIV SERPINB1, TSN, FURIN SLC6A2 3257/4885LGALS8 510/4885PDE4D 3734/4885
US-20160038520-A1 TANNIN INHIBITORS OF HIV SERPINB1, TSN, FURIN SLC6A2 3257/4885LGALS8 510/4885PDE4D 3734/4885

“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.