SCHEMBL7643171

SCHEMBL7643171

O=C(O)C(CCc1ccc2ccccc2c1)N(Cc1ccccc1)[PH](=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
ACHE P22303 1/20 0.41
SOX18 P35713 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
SLC13A5 Q86YT5 1/20 0.39
PDPK1 O15530 1/20 0.39
MC4R P32245 3/20 0.39
MC5R P33032 3/20 0.39
MC3R P41968 2/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
SLC7A11 Q9UPY5 1/20 0.38
MC1R Q01726 1/20 0.38
UTS2R Q9UKP6 1/20 0.37
HDAC1 Q13547 1/20 0.37

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
SCHEMBL7645575 0.79 CYP1A2 (0.55) CYP1A2SLC13A5PDPK1MC4RMC5R
SCHEMBL7645012 0.79 OPRM1 (0.40) SLC6A2SLC6A3SLC1A3SLC1A2SLC1A1
SCHEMBL3380508 0.78 CPA3 (0.46) CYP1A2SLC6A3HDAC1
SCHEMBL7643175 0.72 UTS2R (0.41) CYP1A2ACHESLC6A2SLC6A4SLC6A3
SCHEMBL27862101 0.71 CYP1A2 (0.57) CYP1A2SOX18SLC13A5PDPK1PPARG
SCHEMBL5320165 0.70 CYP1A2 (0.55) CYP1A2SOX18SLC13A5PDPK1MC4R
SCHEMBL8299432 0.70 CTSB (0.43) CYP1A2SOX18SLC13A5PPARGPPARA
SCHEMBL7647484 0.69 KMT2A (0.38)
SCHEMBL1860153 0.69 CYP1A2 (0.57) CYP1A2SOX18HDAC1
SCHEMBL7647619 0.68 HCAR3 (0.41) SLC6A2SLC6A3SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151503-A1 Methods of cancer treatment using naaladase inhibitors SLUSHER BARBARA S (US) 2002-10-17 US claimed

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-20020151503-A1 Methods of cancer treatment using naaladase inhibitors NAALAD2, DNPEP, ACP3 CYP1A2 4583/4885ACHE 1037/4885SOX18 3038/4885

“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.