SCHEMBL7332200

SCHEMBL7332200

CC(C)N1C(=O)C(c2ccccc2)N(C(C)CC(=O)OC(=O)C(F)(F)F)C(=O)c2cc(CCC(=O)NCCN)ccc21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.32
LMNA P02545 1/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL7325106 0.93 LMNA (0.32) SLC6A9LMNABCHEACHEALDH1A1
SCHEMBL7324810 0.93 SLC6A9 (0.31) SLC6A9
SCHEMBL7326298 0.92 SLC6A9 (0.35) SLC6A9LMNABCHEACHEALDH1A1
SCHEMBL8842698 0.91 SLC6A9 (0.32) SLC6A9LMNABCHEACHEALDH1A1
SCHEMBL7334236 0.90 HDAC3 (0.36) SLC6A9LMNABCHEACHEALDH1A1
SCHEMBL7329548 0.88 MDM2 (0.31)
SCHEMBL7328624 0.85 SLC6A9 (0.30) SLC6A9
SCHEMBL7331835 0.85 SLC6A9 (0.34) SLC6A9LMNABCHEACHEALDH1A1
SCHEMBL7331102 0.85
SCHEMBL7324383 0.85 MDM2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663166-A ANTICOAGULANTS OF 1,4-BENZODIAZEPINE-2,5-DIONE AND 2-BENZOAZEPINE-1,4-DIONE DERIVATIVES; PREVENTS FIBRINOGEN BINDING NECESSARY FOR PLATELET AGGREGATION; SIDE EFFECT REDUCTION, E.G. EXCESSIVE BLEEDING GENENTECH, INC. (US) 1997-09-02 US disclosed
US-5565449-A PLATELET AGGREGATION INHIBITORS GENENTECH, INC. (US) 1996-10-15 US disclosed
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP disclosed
US-5403836-A Anticoagulants GENENTECH, INC. (US) 1995-04-04 US disclosed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
US-5250679-A Nonpeptidyl platelet aggregation inhibitors having specificity for the GPIIb III.sub. receptor GENENTECH, INC. (US) 1993-10-05 US disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed