SCHEMBL2868611

SCHEMBL2868611

COc1ccc(N2CC(NC(=O)OCc3ccccc3)CC2=O)cc1F

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.55
POLB P06746 4/20 0.54
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
ACHE P22303 2/20 0.51
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
LMNA P02545 1/20 0.47

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
SCHEMBL2856861 0.83 POLB (0.58) TP53POLBLMNA
SCHEMBL12803837 0.81 LMNA (0.66) TP53POLBLMNA
SCHEMBL3286832 0.78 TP53 (0.48) TP53POLBMAOAMAOBLMNA
SCHEMBL12345122 0.76 ALDH1A1 (0.55) CA1CA2ACHE
SCHEMBL12841266 0.74 MAOA (0.52) TP53POLBMAOAMAOBLMNA
SCHEMBL2858045 0.73 TSHR (0.74) POLBCA1CA2
SCHEMBL2863534 0.73 TSHR (0.56) TP53POLB
SCHEMBL26104288 0.72 LMNA (0.55) TP53POLBLMNA
SCHEMBL3367066 0.71 TP53 (0.64) TP53POLBMAOAMAOBLMNA
SCHEMBL3367069 0.71 TP53 (0.64) TP53POLBMAOAMAOBLMNA

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
EP-1827434-B1 QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER AMGEN INC (US) 2014-01-15 EP disclosed
US-7652009-B2 Substituted heterocycles and methods of use AMGEM INC. (US) 2010-01-26 US disclosed
EP-1827434-A2 QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER Amgen Inc. (US) 2007-09-05 EP disclosed
US-20060252777-A1 Substituted heterocycles and methods of use AMGEN INC. (US) 2006-11-09 US disclosed
WO-2006060318-A2 QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER AMGEN INC. (US) 2006-06-08 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-20060252777-A1 Substituted heterocycles and methods of use HGF, HGFAC, MET TP53 71/4885POLB 1242/4885CA1 3324/4885

“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.