SCHEMBL6398159

SCHEMBL6398159

COC(=O)C(NC(=O)c1ccc(C(N)C(=O)OC(C)(C)C)cc1)C(C)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 1/20 0.42
▸ TAS1R3 Q7RTX0 5/20 0.42
▸ TAS1R1 Q7RTX1 5/20 0.42
▸ LNPEP Q9UIQ6 1/20 0.42
▸ CA2 P00918 3/20 0.41
▸ CA1 P00915 2/20 0.41
▸ NR1H4 Q96RI1 1/20 0.38
▸ MLYCD O95822 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ KLK5 Q9Y337 1/20 0.35

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
SCHEMBL7448758 0.80 KMT2A (0.39) —
SCHEMBL7446914 0.78 TACR3 (0.44) —
SCHEMBL2569650 0.77 MAPT (0.45) CA2CA1
SCHEMBL6395877 0.76 NAMPT (0.50) ERAP2TAS1R3TAS1R1NR1H4KLK5
SCHEMBL8281658 0.74 TAS1R3 (0.54) TAS1R3TAS1R1CA2CA1
SCHEMBL160178 0.74 GAA (0.54) TAS1R3TAS1R1LNPEPCA2CA1
SCHEMBL225433 0.74 GAA (0.54) TAS1R3TAS1R1LNPEPCA2CA1
SCHEMBL506934 0.74 ANPEP (0.45) CA2CA1NR1H4
SCHEMBL6231982 0.74 GAA (0.54) TAS1R3TAS1R1LNPEPCA2CA1
SCHEMBL5673253 0.74 GAA (0.54) TAS1R3TAS1R1LNPEPCA2CA1

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-20050026929-A1 Novel phenyl derivatives as inducers of apoptosis AXYS PHARMACEUTICALS, INC. (US) 2005-02-03 — — US disclosed
WO-2003090680-A2 NOVEL PHENYL DERIVATIVES AS INDUCERS OF APOPTOSIS AXYS PHARMACEUTICALS, INC. (US) 2003-11-06 — — WO 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-20050026929-A1 Novel phenyl derivatives as inducers of apoptosis BAX, BAD, CASP3 ERAP2 522/4885TAS1R3 3991/4885TAS1R1 4276/4885

“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.

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