SCHEMBL1460155

SCHEMBL1460155

O=C(Cc1cc(F)cc(F)c1)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR34 Q9UPC5 4/20 0.57
▸ ACE P12821 6/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ ITGB3 P05106 1/20 0.54
▸ ITGA2B P08514 1/20 0.54
▸ ECE1 P42892 1/20 0.53
▸ MME P08473 1/20 0.52
▸ CTSL P07711 1/20 0.52
▸ CTSB P07858 1/20 0.52
▸ CTSS P25774 1/20 0.52
▸ CNR2 P34972 2/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL27996333 0.90 MME (0.53) GPR34ACEMMECTSLCTSB
SCHEMBL5967322 0.90 MME (0.53) GPR34ACEMMECTSLCTSB
SCHEMBL10504767 0.88 ITGB3 (0.65) ACEITGB3ITGA2BECE1MME
SCHEMBL4144665 0.88 ITGB3 (0.65) ACEITGB3ITGA2BECE1MME
SCHEMBL4144668 0.88 ITGB3 (0.65) ACEITGB3ITGA2BECE1MME
SCHEMBL16452927 0.87 CNR2 (0.64) GPR34ACEALDH1A1ITGB3ITGA2B
SCHEMBL16452918 0.85 CNR2 (0.58) GPR34ACEALDH1A1ITGB3ITGA2B
SCHEMBL17431819 0.83 GPR34 (0.62) GPR34ACEALDH1A1ITGB3ITGA2B
SCHEMBL3342648 0.83 PIN1 (0.62) —
SCHEMBL1458962 0.82 TACR1 (0.56) ACEITGB3ITGA2BMMECTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822698-B2 Aminoacid derivatives, their process of preparation and their therapeutical uses as inhibitors of oncogenic signals by the Met family UNIVERSITE D'AIX-MARSEILLE (FR) 2014-09-02 — — US disclosed
US-20130085143-A1 AMINOACID DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES AS INHIBITORS OF ONCOGENIC SIGNALS BY THE MET FAMILY UNIVERSITE D'AIX-MARSEILLE (FR) 2013-04-04 — — US disclosed
EP-2483280-A1 NEW AMINOACID DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES AS INHIBITORS OF ONCOGENIC SIGNALS BY THE MET FAMILY Université d'Aix-Marseille (FR) 2012-08-08 — — EP disclosed
EP-2305688-A1 Novel aminoacids derivatives, their process of preparation and their therapeutical uses as MET inhibitors Université de la Méditerranée - Aix-Marseille II (FR) 2011-04-06 — — EP disclosed
WO-2011036303-A1 NEW AMINOACID DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES AS INHIBITORS OF ONCOGENIC SIGNALS BY THE MET FAMILY UNIVERSITE DE LA MEDITERRANEE AIX-MARSEILLE II (FR) 2011-03-31 — — 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-20130085143-A1 AMINOACID DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES AS INHIBITORS OF ONCOGENIC SIGNALS BY THE MET FAMILY MET, HGFAC, HRAS GPR34 3513/4885ACE 3192/4885ALDH1A1 3162/4885

“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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