SCHEMBL3502159

SCHEMBL3502159

C=CC(I)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.48
NAALAD2 Q9Y3Q0 1/20 0.48
SLC7A5 Q01650 1/20 0.45
MME P08473 6/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ACE P12821 7/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43

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
SCHEMBL3082077 0.79 CA1 (0.46) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL3082072 0.79 CA1 (0.46) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL31398551 0.78 FOLH1 (0.52) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL3983123 0.78 FOLH1 (0.59) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL3983134 0.78 FOLH1 (0.59) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL9847993 0.76 FOLH1 (0.54) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL5738141 0.76 FOLH1 (0.61) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL9847998 0.76 FOLH1 (0.54) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL12869808 0.76 FOLH1 (0.61) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL55972 0.76 FOLH1 (0.56) FOLH1NAALAD2SLC7A5MMEMEN1

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-8486885-B2 β-arrestin effectors and compositions and methods of use thereof TREVENA, INC. (US) 2013-07-16 US disclosed
US-20100184701-A1 Beta-Arrestin Effectors And Compositions And Methods Of Use Thereof TREVENA, INC. 2010-07-22 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-20100184701-A1 Beta-Arrestin Effectors And Compositions And Methods Of Use Thereof ARRB1, ADRB1, ADRB3 FOLH1 4437/4885NAALAD2 2569/4885SLC7A5 4709/4885

“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.