SCHEMBL7325137

SCHEMBL7325137

CCOC(=O)CCNC(=O)c1ccccc1NC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.51
HCRTR1 O43613 2/20 0.48
KDM4E B2RXH2 4/20 0.46
POLB P06746 1/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TSHR P16473 2/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TOP2A P11388 1/20 0.44
MCL1 Q07820 1/20 0.44
PRSS1 P07477 1/20 0.43
CTSG P08311 1/20 0.43
CTRB1 P17538 1/20 0.43
CMA1 P23946 1/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL6185528 0.92 ALDH1A1 (0.51) CRBNHCRTR1KDM4EALDH1A1TSHR
SCHEMBL13468193 0.84 CHRM1 (0.55) HCRTR1ALDH1A1TSHRHTTHSD17B10
SCHEMBL13469342 0.83 HCRTR1 (0.50) HCRTR1ALDH1A1TSHRHTTHPGD
SCHEMBL7323307 0.82 CYP1A2 (0.39) KDM4EALDH1A1HPGDSMN1; SMN2TOP2A
SCHEMBL15614413 0.81 HCRTR1 (0.51) HCRTR1ALDH1A1TSHRHTTTOP2A
SCHEMBL15528646 0.81 HCRTR1 (0.76) HCRTR1ALDH1A1TSHRHSD17B10HPGD
SCHEMBL2577570 0.81 L3MBTL1 (0.64) CRBNHCRTR1KDM4EPOLBATM
SCHEMBL27375291 0.80 CHRNB2 (0.54) HCRTR1HTT
SCHEMBL11214944 0.78 L3MBTL1 (0.53) KDM4EPOLBATMALDH1A1HTT
SCHEMBL17725520 0.78 HCRTR1 (0.46) HCRTR1POLBALDH1A1TSHRHTT

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-5674863-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5674865-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
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
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed