SCHEMBL15280895

SCHEMBL15280895

CCC1O[C@@H](OCc2ccccc2)C(C)[C@@H](C)[C@@H]1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGF1 P05230 2/20 0.39
FGF2 P09038 2/20 0.39
VEGFA P15692 2/20 0.39
HPSE Q9Y251 2/20 0.39
SSTR5 P35346 2/20 0.38
SSTR1 P30872 1/20 0.38
SSTR2 P30874 1/20 0.38
SSTR4 P31391 1/20 0.38
SSTR3 P32745 1/20 0.38
BCHE P06276 1/20 0.36
SLC6A2 P23975 1/20 0.35
NT5E P21589 1/20 0.34
TSHR P16473 3/20 0.34
CYP2C19 P33261 2/20 0.33
PDPK1 O15530 1/20 0.33
MTOR P42345 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL15504369 0.88 FGF1 (0.43) FGF1FGF2VEGFAHPSESSTR5
SCHEMBL18328600 0.88 FGF1 (0.43) FGF1FGF2VEGFAHPSESSTR5
SCHEMBL4404459 0.87 SLC6A2 (0.40) FGF1FGF2VEGFAHPSESSTR5
SCHEMBL16640651 0.87 SLC6A2 (0.40) FGF1FGF2VEGFAHPSESSTR5
SCHEMBL18718054 0.86 SLC6A2 (0.44) FGF1FGF2VEGFAHPSESLC6A2
SCHEMBL12920541 0.86 FGF1 (0.43) FGF1FGF2VEGFAHPSESSTR5
SCHEMBL14667229 0.85 SSTR1 (0.44) FGF1FGF2VEGFAHPSESSTR5
SCHEMBL17447101 0.83 LGALS8 (0.43) SLC6A2TSHRALDH1A1CYP3A4MAPK1
SCHEMBL17174992 0.82 SSTR5 (0.50) FGF1FGF2VEGFAHPSESSTR5
SCHEMBL16367561 0.82 SSTR5 (0.50) FGF1FGF2VEGFAHPSESSTR5

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 FGF1 4025/4885FGF2 4278/4885VEGFA 3515/4885
US-20160038520-A1 TANNIN INHIBITORS OF HIV SERPINB1, TSN, FURIN FGF1 4025/4885FGF2 4278/4885VEGFA 3515/4885

“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.