SCHEMBL2914617

SCHEMBL2914617

CC(C)S(=O)(=O)c1ccc(N)cc1[C@@H]1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NR1H2 P55055 1/20 0.42
F7 P08709 11/20 0.42
F3 P13726 11/20 0.42
F2 P00734 6/20 0.42
F10 P00742 6/20 0.42
F11 P03951 6/20 0.42
KLK1 P06870 1/20 0.40
NPSR1 Q6W5P4 3/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL2910772 1.00 MEN1 (0.43) MEN1KMT2ANR1H2F7F3
SCHEMBL2910770 1.00 MEN1 (0.43) MEN1KMT2ANR1H2F7F3
SCHEMBL2916946 0.87 F7 (0.45) F7F3F2F10F11
SCHEMBL13613598 0.86 NR1H2 (0.43) MEN1KMT2ANR1H2NPSR1LMNA
SCHEMBL13613594 0.86 NR1H2 (0.43) MEN1KMT2ANR1H2NPSR1LMNA
SCHEMBL13613597 0.86 NR1H2 (0.43) MEN1KMT2ANR1H2NPSR1LMNA
SCHEMBL13613436 0.84 MEN1 (0.46) MEN1KMT2ANR1H2NPSR1LMNA
SCHEMBL2912061 0.80 NR1H2 (0.41) MEN1KMT2ANR1H2F7F3
SCHEMBL3077286 0.80 NR1H2 (0.41) MEN1KMT2ANR1H2F7F3
SCHEMBL2913738 0.80 NR1H2 (0.41) MEN1KMT2ANR1H2F7F3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856096-B1 PHENYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2010-09-01 EP disclosed
EP-2222647-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS Cephalon, Inc. (US) 2010-09-01 EP disclosed
US-7622585-B2 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-24 US disclosed
US-7622585-B2 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-24 US disclosed
WO-2008051547-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS CEPHALON, INC. (US) 2008-05-02 WO disclosed
US-20060166997-A1 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY 2006-07-27 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-20060166997-A1 Phenylglycinamide derivatives useful as anticoagulants TFPI, SERPINC1, SERPINE1 MEN1 2580/4885KMT2A 860/4885NR1H2 4140/4885

“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.