SCHEMBL13536737

SCHEMBL13536737

COC(=O)C(Cc1ccc(C)cc1)NC(=O)OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
ALDH1A1 P00352 3/20 0.66
ALOX15 P16050 1/20 0.66
CTSL P07711 3/20 0.60
CTSK P43235 3/20 0.60
CTSB P07858 2/20 0.60
CTSS P25774 2/20 0.60
CYP3A4 P08684 3/20 0.59
TSHR P16473 3/20 0.59
MEN1 O00255 1/20 0.59
MAPT P10636 1/20 0.59
KMT2A Q03164 1/20 0.59
TACR1 P25103 2/20 0.58
KYNU Q16719 1/20 0.58
TRPM8 Q7Z2W7 1/20 0.56

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
SCHEMBL7151822 0.93 ALDH1A1 (0.74) ATMALDH1A1ALOX15CTSLCTSK
SCHEMBL329686 0.93 ALDH1A1 (0.74) ATMALDH1A1ALOX15CTSLCTSK
Hydrochloric Acid SCHEMBL7928050 0.92 ALDH1A1 (0.72) ATMALDH1A1ALOX15CTSLCTSK
SCHEMBL11581694 0.91 ATM (0.55) ATML3MBTL1ALDH1A1ALOX15CTSL
SCHEMBL13536734 0.91 ITGB3 (0.63) ALDH1A1ALOX15CTSLCTSKCTSB
SCHEMBL2402461 0.91 ALDH1A1 (0.67) ATMALDH1A1ALOX15CTSLCTSK
SCHEMBL11581697 0.91 ATM (0.55) ATML3MBTL1ALDH1A1ALOX15CTSL
SCHEMBL30427977 0.91 ITGB3 (0.63) ALDH1A1ALOX15CTSLCTSKCTSB
SCHEMBL5399986 0.91 ALDH1A1 (0.67) ATMALDH1A1ALOX15CTSLCTSK
SCHEMBL7294741 0.91 ALDH1A1 (0.67) ATMALDH1A1ALOX15CTSLCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023222866-A1 DOSE AND REGIMEN FOR A HETEROCYCLIC PHOSPHINIC COMPOUND PHOST'IN THERAPEUTICS (FR) 2023-11-23 WO disclosed
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 ATM 1678/4885L3MBTL1 837/4885ALDH1A1 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.