SCHEMBL7325460

SCHEMBL7325460

CNc1ccc(I)cc1C(=O)NC(C)CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.38
PTPN2 P17706 1/20 0.38
PTPN1 P18031 1/20 0.38
PTPRA P18433 1/20 0.38
PTPRB P23467 1/20 0.38
PTPRE P23469 1/20 0.38
PTPN6 P29350 1/20 0.38
CA12 O43570 1/20 0.36
CA7 P43166 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ITGB3 P05106 2/20 0.35
ITGA2B P08514 2/20 0.35
CYP26A1 O43174 4/20 0.35
PYGL P06737 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 2/20 0.34
MAP2K2 P36507 1/20 0.34
MAP2K1 Q02750 1/20 0.34
CASP3 P42574 1/20 0.34

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
SCHEMBL7321127 0.87 ALDH1A1 (0.36) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL7330770 0.84 THRB (0.36) MEN1KMT2APOLBMAP2K2MAP2K1
SCHEMBL7673771 0.80 KMT2A (0.49) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL1114971 0.75 TTR (0.40) MEN1KMT2ACYP26A1POLBEGLN1
SCHEMBL8959409 0.75 NPSR1 (0.40) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL9318974 0.74 CYP26A1 (0.44) MEN1KMT2ACYP26A1MAPT
SCHEMBL2384775 0.74 PTPRC (0.64) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL7332776 0.73 ALDH1A1 (0.44) MEN1KMT2AITGB3ITGA2BCYP26A1
SCHEMBL7331581 0.73 THRB (0.36) MEN1KMT2APOLBMAP2K2MAP2K1
SCHEMBL7329567 0.72 ATM (0.40) MEN1KMT2AMAPTPOLBMAP2K2

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 9 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
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