SCHEMBL14985679

SCHEMBL14985679

CON(C)C(=O)CC[C@@H](N)C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 9/20 0.47
ALDH1A1 P00352 3/20 0.43
IDO1 P14902 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
SLC15A1 P46059 2/20 0.41
SLC1A3 P43003 1/20 0.40
SLC1A1 P43005 1/20 0.40
LAP3 P28838 1/20 0.39

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
SCHEMBL12869912 0.81 LTA4H (0.54) LTA4HALDH1A1IDO1SLC15A1SLC1A3
SCHEMBL17375358 0.81 LTA4H (0.54) LTA4HALDH1A1IDO1SLC15A1SLC1A3
SCHEMBL29500229 0.81 ALDH1A1 (0.42) ALDH1A1MAPTHPGDSLC15A1
SCHEMBL28192478 0.80 LTA4H (0.56) LTA4HALDH1A1IDO1SLC15A1SLC1A3
SCHEMBL21232385 0.80 LTA4H (0.56) LTA4HALDH1A1IDO1SLC15A1SLC1A3
SCHEMBL124387 0.80 LTA4H (0.56) LTA4HALDH1A1IDO1SLC15A1SLC1A3
SCHEMBL561573 0.80 LTA4H (0.56) LTA4HALDH1A1IDO1SLC15A1SLC1A3
SCHEMBL21274457 0.80 LTA4H (0.47) LTA4HALDH1A1IDO1HPGDSLC15A1
SCHEMBL21274456 0.80 LTA4H (0.47) LTA4HALDH1A1IDO1HPGDSLC15A1
SCHEMBL27324538 0.80 LTA4H (0.59) LTA4HALDH1A1SLC15A1SLC1A3SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170029408-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-02-02 US disclosed
US-8841278-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2014-09-23 US disclosed
US-8822430-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2014-09-02 US disclosed
US-20140039021-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-02-06 US disclosed
US-8575118-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-11-05 US disclosed
US-20130137877-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-05-30 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 (3 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-20170029408-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 LTA4H 3111/4885ALDH1A1 3957/4885IDO1 889/4885
US-20130137877-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 LTA4H 3111/4885ALDH1A1 3957/4885IDO1 889/4885
US-20140039021-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 LTA4H 3111/4885ALDH1A1 3957/4885IDO1 889/4885

“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.