SCHEMBL7797590

SCHEMBL7797590

N[C@H](CC(=O)c1ccc(Cl)c(Cl)c1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 1.00
TSHR P16473 1/20 0.52
SLC6A4 P31645 1/20 0.49
SLC6A3 Q01959 1/20 0.49

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
SCHEMBL7797582 1.00 KMO (1.00) KMOTSHRSLC6A4SLC6A3
SCHEMBL7797593 1.00 KMO (1.00) KMOTSHRSLC6A4SLC6A3
Hydrochloric Acid SCHEMBL8057534 0.98 KMO (1.00) KMOTSHRSLC6A4SLC6A3
Hydrochloric Acid SCHEMBL7908769 0.98 KMO (1.00) KMOTSHRSLC6A4SLC6A3
Hydrochloric Acid SCHEMBL8393037 0.98 KMO (1.00) KMOTSHRSLC6A4SLC6A3
SCHEMBL19642672 0.84 KMO (0.75) KMOTSHRSLC6A4SLC6A3
SCHEMBL6490028 0.81 KMO (0.69) KMO
SCHEMBL6490023 0.81 KMO (0.69) KMO
SCHEMBL3670421 0.81 KMO (1.00) KMOTSHRSLC6A4SLC6A3
SCHEMBL4386002 0.81 KMO (1.00) KMOTSHRSLC6A4SLC6A3

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-20010008947-A1 2-AMINO-4-PHENYL-4-OXO-BUTYRIC ACID DERIVATIVES VARASI MARIO (IT) 2001-07-19 US disclosed
EP-0662948-B1 2-AMINO-4-PHENYL-4-OXO-BUTYRIC ACID DERIVATIVES WITH KYNURENINASE AND/OR KYNURENINE-3-HYDROXYLASE INHIBITING ACTIVITY PHARMACIA & UPJOHN SPA (IT) 1998-10-07 EP 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-20010008947-A1 2-AMINO-4-PHENYL-4-OXO-BUTYRIC ACID DERIVATIVES KYNU, KMO, ABAT KMO 2/4885TSHR 4661/4885SLC6A4 468/4885

“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.