SCHEMBL13534741

SCHEMBL13534741

CC(C)(C)[Si](C)(C)Oc1cccc(C[C@@H](N)C(=O)OCc2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 4/20 0.43
BTN3A1 O00481 1/20 0.42
ALDH1A1 P00352 2/20 0.41
LTA4H P09960 3/20 0.40
SLC15A1 P46059 1/20 0.40
LAP3 P28838 1/20 0.40
MAOB P27338 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
MAOA P21397 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
ADORA1 P30542 1/20 0.39
GRIA2 P42262 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.38
ALPI P09923 1/20 0.38
PKM P14618 1/20 0.38
PTGS1 P23219 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
SCHEMBL14599835 1.00 SLC7A5 (0.43) SLC7A5BTN3A1ALDH1A1LTA4HSLC15A1
SCHEMBL13535118 0.89 LTA4H (0.49) SLC7A5BTN3A1ALDH1A1LTA4HSLC15A1
SCHEMBL14599836 0.87 BTN3A1 (0.43) BTN3A1ALDH1A1MAOBMAPTSMN1; SMN2
SCHEMBL13534739 0.87 BTN3A1 (0.43) BTN3A1ALDH1A1MAOBMAPTSMN1; SMN2
SCHEMBL13536742 0.87 SLC7A5 (0.45) SLC7A5ALDH1A1LTA4H
SCHEMBL25021582 0.85 OPRK1 (0.41)
SCHEMBL7669184 0.81 ALDH1A1 (0.49) ALDH1A1MAOB
SCHEMBL2039627 0.81 SMN1; SMN2 (0.56) ALDH1A1LTA4HLAP3MAOBKDM4E
SCHEMBL20905989 0.81 SMN1; SMN2 (0.56) ALDH1A1LTA4HLAP3MAOBKDM4E
Hydrochloric Acid SCHEMBL29985601 0.80 SMN1; SMN2 (0.55) ALDH1A1LTA4HLAP3MAOBKDM4E

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-7649015-B2 Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds GILEAD SCIENCES, INC. (US) 2010-01-19 US disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 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 (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-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 SLC7A5 1918/4885BTN3A1 3617/4885ALDH1A1 3337/4885

“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.